name: XGPT_ECOLI Xanthine-guanine phosphoribosyltransferase (sprot)

description: A xanthine-guanine phosphoribosyltransferase that is encoded in the genome of Escherichia coli K-12.


name: CXCR4_RAT C-X-C chemokine receptor type 4 (sprot)

description: A C-X-C chemokine receptor type 4 that is encoded in the genome of rat.


plerixafor

An azamacrocycle consisting of two cyclam rings connected by a 1,4-phenylenebis(methylene) linker. It is a CXCR4 chemokine receptor antagonist and a hematopoietic stem cell mobilizer. It is used in combination with grulocyte-colony stimulating factor (G-CSF) to mobilize hematopoietic stem cells to the perpheral blood for collection and subsequent autologous transplantation in patients with non-Hodgkin's lymphoma and multiple myeloma.


name: TERA_MOUSE Transitional endoplasmic reticulum ATPase (sprot)

description: A transitional endoplasmic reticulum ATPase that is encoded in the genome of mouse.


name: 4-Amino-3-[2-[6-(4-fluoro-2-methylphenyl)-3-pyridinyl]diazenyl]-1-naphthalenesulfonic acid, monosodium salt


name: US9526727, Comparison Example Table 2, (1r,4r)-2''-amino-4-methoxy-1''-(2-methoxyethyl)-5''-oxo-1'',5''-dihydro-3'H-dispiro[cyclohexane-1,2'-indene-1',4''-imidazole]-6'-carbonitrile


name: US9526727, Comparison Example Table 2, 2''-amino-4-methoxy-5''-oxo-1''-(oxolan-2-ylmethyl)-1'',5''-dihydro-3'H-dispiro[cyclohexane-1,2'-indene-1',4''-imidazole]-6'-carbonitrile


name: LYPL1_HUMAN Lysophospholipase-like protein 1 (sprot)

description: A lysophospholipase-like protein 1 that is encoded in the genome of human.


An L-alpha-amino acid anion that is the conjugate base of O(4')-sulfo-L-tyrosine; major species ar pH 7.3.


name: SRC_RSVSA Tyrosine-protein kinase transforming protein Src (sprot)


name: SRC_RSVSE Tyrosine-protein kinase transforming protein Src (sprot)


An optically active form of O(4)-phosphonatotyrosine(2-) having L-configuration.


name: IDHP_HUMAN Isocitrate dehydrogenase [NADP], mitochondrial (sprot)

description: An isocitrate dehydrogenase [NADP], mitochondrial that is encoded in the genome of human.


name: AIG1_HUMAN Androgen-induced gene 1 protein (sprot)

description: An androgen-induced gene 1 protein that is encoded in the genome of human.


name: ADTRP_HUMAN Androgen-dependent TFPI-regulating protein (sprot)

description: An androgen-dependent TFPI-regulating protein that is encoded in the genome of human.


name: SERA_HUMAN D-3-phosphoglycerate dehydrogenase (sprot)

description: A D-3-phosphoglycerate dehydrogenase that is encoded in the genome of human.


name: KDM2B_HUMAN Lysine-specific demethylase 2B (sprot)

description: A lysine-specific demethylase 2B that is encoded in the genome of human.


name: KDM3B_HUMAN Lysine-specific demethylase 3B (sprot)

description: A lysine-specific demethylase 3B that is encoded in the genome of human.


name: PHF8_HUMAN Histone lysine demethylase PHF8 (sprot)

description: A histone lysine demethylase PHF8 that is encoded in the genome of human.


name: KDM6B_HUMAN Lysine-specific demethylase 6B (sprot)

description: A lysine-specific demethylase 6B that is encoded in the genome of human.


name: KDM3A_HUMAN Lysine-specific demethylase 3A (sprot)

description: A lysine-specific demethylase 3A that is encoded in the genome of human.


name: 4-[3-(dimethylamino)propylamino]-7,8-dimethyl-3-quinolinecarboxylic acid ethyl ester


name: 2-Amino-3-[5-(4-phenoxyphenyl)-1H-indol-3-yl]propionic acid ethyl ester


name: 2-tert-Butoxycarbonylamino-3-[6-(4-phenoxyphenyl)-1H-indol-3-yl]-propionic acid ethyl ester


name: 2-Nitro-3-[5-(4-phenoxyphenyl)-1H-indol-3-yl]propionic acid ethyl ester


name: MUC18_MOUSE Cell surface glycoprotein MUC18 (sprot)

description: A cell surface glycoprotein MUC18 that is encoded in the genome of mouse.


SORT_MOUSE Sortilin (sprot)

A sortilin that is encoded in the genome of mouse.


name: KCNA5_HUMAN Potassium voltage-gated channel subfamily A member 5 (sprot)

description: A voltage-gated potassium channel subunit KCNA5 that is encoded in the genome of human.


name: XPP2_HUMAN Xaa-Pro aminopeptidase 2 (sprot)

description: An Xaa-Pro aminopeptidase 2 that is encoded in the genome of human.


name: ACE_HUMAN Angiotensin-converting enzyme (sprot)

description: An angiotensin-converting enzyme that is encoded in the genome of human.


FEN1_HUMAN Flap endonuclease 1 (sprot)

A flap endonuclease 1 that is encoded in the genome of human.


name: FABPL_MOUSE Fatty acid-binding protein, liver (sprot)

description: A fatty acid-binding protein, liver that is encoded in the genome of mouse.


An endocannabinoid and an endogenous agonist of the cannabinoid receptors (CB1 and CB2). It is an ester formed from omega-6-arachidonic acid and glycerol.


2-oleoyl glycerol

A 2-monoglyceride where the acyl group is (9Z)-octadecenoyl.


A 2-monoglyceride where the acyl group is hexadecanoyl (palmitoyl).


A diterpenoid that is 6a,7,8,10a-tetrahydro-6H-benzo[c]chromene substituted at position 1 by a hydroxy group, positions 6, 6 and 9 by methyl groups and at position 3 by a pentyl group. The principal psychoactive constituent of the cannabis plant, it is used for treatment of anorexia associated with AIDS as well as nausea and vomiting associated with cancer chemotherapy.


cannabidiol

An cannabinoid that is cyclohexene which is substituted by a methyl group at position 1, a 2,6-dihydroxy-4-pentylphenyl group at position 3, and a prop-1-en-2-yl group at position 4.


aldehydo-D-galactose 6-phosphate

The ring-opened aldehydo-form of D-galactose 6-phosphate.


name: FGD_MYCTO F420-dependent glucose-6-phosphate dehydrogenase (sprot)


quizartinib

A member of the class of phenylureas that is urea in which one of the amino groups has been substituted by a 5-tert-butyl-1,2-oxazol-3-yl group while the other has been substituted by a phenyl group substituted at the para- position by an imidazo[2,1-b][1,3]benzothiazol-2-yl group that, in turn, is substituted at position 7 by a 2-(morpholin-4-yl)ethoxy group.


name: MMP2_RAT 72 kDa type IV collagenase (sprot)

description: A 72 kDa type IV collagenase that is encoded in the genome of rat.


name: MMP9_RAT Matrix metalloproteinase-9 (sprot)

description: A matrix metalloproteinase-9 that is encoded in the genome of rat.


name: PARP4_HUMAN Protein mono-ADP-ribosyltransferase PARP4 (sprot)

description: A protein mono-ADP-ribosyltransferase PARP4 that is encoded in the genome of human.


name: PAR15_HUMAN Protein mono-ADP-ribosyltransferase PARP15 (sprot)

description: A protein mono-ADP-ribosyltransferase PARP15 that is encoded in the genome of human.


name: PAR14_HUMAN Protein mono-ADP-ribosyltransferase PARP14 (sprot)

description: A protein mono-ADP-ribosyltransferase PARP14 that is encoded in the genome of human.


name: PAR10_HUMAN Protein mono-ADP-ribosyltransferase PARP10 (sprot)

description: A protein mono-ADP-ribosyltransferase PARP10 that is encoded in the genome of human.


name: PAR16_HUMAN Protein mono-ADP-ribosyltransferase PARP16 (sprot)

description: A protein mono-ADP-ribosyltransferase PARP16 that is encoded in the genome of human.


LIPG_MOUSE Endothelial lipase (sprot)

An endothelial lipase that is encoded in the genome of mouse.


KLK1_HUMAN Kallikrein-1 (sprot)

A kallikrein-1 that is encoded in the genome of human.


azacitidine

An N-glycosyl-1,3,5-triazine that is 4-amino-1,3,5-triazin-2(1H)-one substituted by a beta-D-ribofuranosyl residue via an N-glycosidic linkage. An antineoplastic agent, it is used in the treatment of myeloid leukaemia.


ribavirin

A 1-ribosyltriazole that is the 1-ribofuranosyl derivative of 1,2,4-triazole-3-carboxamide. A synthetic guanosine analogue, it is an inhibitor of HCV polymerase and possesses a broad spectrum of activity against DNA and RNA viruses.


name: AK1BA_HUMAN Aldo-keto reductase family 1 member B10 (sprot)

description: An aldo-keto reductase family 1 member B10 that is encoded in the genome of human.


CAFFEIC ACID PHENETHYL ESTER

An alkyl caffeate ester in which 2-phenylethyl is the alkyl component.


ELAV1_HUMAN ELAV-like protein 1 (sprot)

An ELAV-like protein 1 that is encoded in the genome of human.


name: CFTR_HUMAN Cystic fibrosis transmembrane conductance regulator (sprot)

description: A cystic fibrosis transmembrane conductance regulator that is encoded in the genome of human.


mepacrine

A member of the class of acridines that is acridine substituted by a chloro group at position 6, a methoxy group at position 2 and a [5-(diethylamino)pentan-2-yl]nitrilo group at position 9.


name: PCSK9_HUMAN Proprotein convertase subtilisin/kexin type 9 (sprot)

description: A proprotein convertase subtilisin/kexin type 9 that is encoded in the genome of human.


A triazolopyridine that is 3H-[1,2,3]triazolo[4,5-b]pyridine substituted by a 4-{(3-chloropyridin-2-yl)[(3R)-piperidin-3-yl]carbamoyl}phenyl group at position 3. It is a potent inhibitor of PCSK9.


name: WDR5_HUMAN WD repeat-containing protein 5 (sprot)

description: A WD repeat-containing protein 5 that is encoded in the genome of human.


name: F263_HUMAN 6-phosphofructo-2-kinase/fructose-2,6-bisphosphatase 3 (sprot)

description: A 6-phosphofructo-2-kinase/fructose-2,6-bisphosphatase 3 that is encoded in the genome of human.


name: F264_HUMAN 6-phosphofructo-2-kinase/fructose-2,6-bisphosphatase 4 (sprot)

description: A 6-phosphofructo-2-kinase/fructose-2,6-bisphosphatase 4 that is encoded in the genome of human.


name: 3-Benzyl-3-[3-(2-cyclopropylmethanesulfonylamino-ethoxy)-phenyl]-azetidine-1-carboxylic acid ethyl ester


A member of the class of pyrazoles that is 1H-pyrazole which is substituted at positions 1, 3 and 5 by 4-methoxyphenyl, trifluoromethyl and 4-chlorophenyl groups, respectively. Unlike many members of the diaryl heterocycle class of cyclooxygenase (COX) inhibitors, SC-560 is selective for COX-1.


quinine

A cinchona alkaloid that is cinchonidine in which the hydrogen at the 6-position of the quinoline ring is substituted by methoxy.


CATE_HUMAN Cathepsin E (sprot)

A cathepsin E that is encoded in the genome of human.


name: WNK1_HUMAN Serine/threonine-protein kinase WNK1 (sprot)

description: A serine/threonine-protein kinase WNK1 that is encoded in the genome of human.


CFAD_MOUSE Complement factor D (sprot)

A complement factor D that is encoded in the genome of mouse.


name: 3,6-Dihydro-2H-pyran-4-boronic acid pinacol ester


PHOSPHONOACETOHYDROXAMATE

The hydroxamate of phosphonoacetic acid.


ENOA_HUMAN Alpha-enolase (sprot)

An alpha-enolase that is encoded in the genome of human.


ENOG_HUMAN Gamma-enolase (sprot)

A gamma-enolase that is encoded in the genome of human.


name: BRDT_HUMAN Bromodomain testis-specific protein (sprot)

description: A bromodomain testis-specific protein that is encoded in the genome of human.


A member of the class of thienotriazolodiazepines that is the tert-butyl ester of [(6S)-4-(4-chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-6-yl]acetic acid. An inhibitor of bromodomain-containing protein 4 that exhibits anti-cancer and cardioprotective properties.


celastrol

A pentacyclic triterpenoid that is 24,25,26-trinoroleana-1(10),3,5,7-tetraen-29-oic acid bearing an oxo substituent at position 2, a hydroxy substituent at position 3 and two methyl groups at positions 9 and 13. An antioxidant and anti-inflammatory agent. Potently inhibits lipid peroxidation in mitochondria and inhibits TNF-alpha-induced NFkappaB activation. Also shown to inhibit topoisomerase II activity in vitro (IC50 = 7.41 muM).


name: SIDA_ASPFU L-ornithine N(5)-monooxygenase (sprot)


name: PQSA_PSEAE Anthranilate--CoA ligase (sprot)


name: IPYR_MYCTU Inorganic pyrophosphatase (sprot)


name: IPYR_ECOLI Inorganic pyrophosphatase (sprot)

description: An inorganic pyrophosphatase Ppa that is encoded in the genome of Escherichia coli K-12.


name: IPYR_YEAST Inorganic pyrophosphatase (sprot)

description: A eukaryotic inorganic pyrophosphatase that is a translation product of the IPP1 gene in yeast.


name: PPAC_STAAR Probable manganese-dependent inorganic pyrophosphatase (sprot)


name: PARG_HUMAN Poly(ADP-ribose) glycohydrolase (sprot)

description: A poly(ADP-ribose) glycohydrolase that is encoded in the genome of human.


name: CDKL2_HUMAN Cyclin-dependent kinase-like 2 (sprot)

description: A cyclin-dependent kinase-like 2 that is encoded in the genome of human.


name: 8-(5-Carboxymethyl-2-methoxy-phenyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid benzyl ester


name: (+/-)-8-[5-(1-Carboxy-ethyl)-2-methoxy-phenyl]-5-fluoro-3,4-dihydro-1H-isoquinoline-2-carboxylic acid benzyl ester


name: 8-(4-Carboxymethoxy-phenyl)-5-fluoro-3,4-dihydro-1H-isoquinoline-2-carboxylic acid benzyl ester


name: 8-(4-Carboxymethyl-2,6-dimethoxy-phenyl)-5-fluoro-3,4-dihydro-1H-isoquinoline-2-carboxylic acid benzyl ester


name: 8-(5-Carboxymethyl-2-cyclopropoxy-phenyl)-5-fluoro-3,4-dihydro-1H-isoquinoline-2-carboxylic acid benzyl ester


name: 8-(5-Carboxymethyl-2-isopropoxy-phenyl)-5-cyano-3,4-dihydro-1H-isoquinoline-2-carboxylic acid benzyl ester


name: IRAK1_HUMAN Interleukin-1 receptor-associated kinase 1 (sprot)

description: An interleukin-1 receptor-associated kinase 1 that is encoded in the genome of human.


name: COMT_HUMAN Catechol O-methyltransferase (sprot)

description: A catechol O-methyltransferase that is encoded in the genome of human.


name: (7S)-1 inverted exclamation marka-{[5-(trifluoromethyl)furan-2-yl]methyl}spiro[furo[2,3-f][1,3]benzodioxole-7,3 inverted exclamation marka-indol]-2 inverted exclamation marka(1 inverted exclamation markaH)-one


isoniazid

A carbohydrazide obtained by formal condensation between pyridine-4-carboxylic acid and hydrazine.


name: MYMA_MYCTU Putative FAD-containing monooxygenase MymA (sprot)


name: WNK3_HUMAN Serine/threonine-protein kinase WNK3 (sprot)

description: A serine/threonine-protein kinase WNK3 that is encoded in the genome of human.


name: WNK4_HUMAN Serine/threonine-protein kinase WNK4 (sprot)

description: A serine/threonine-protein kinase WNK4 that is encoded in the genome of human.


name: US9617250, S-entiomer of Example 22 of D1


butorphanol

Levorphanol in which a hydrogen at position 14 of the morphinan skeleton is substituted by hydroxy and one of the hydrogens of the N-methyl group is substituted by cyclopropyl. A semi-synthetic opioid agonist-antagonist analgesic, it is used as its (S,S)-tartaric acid salt for relief or moderate to severe pain.


name: CGAS_HUMAN Cyclic GMP-AMP synthase (sprot)

description: A protein MB21D1 that is encoded in the genome of human.


name: UNG_VACCC Uracil-DNA glycosylase (sprot)


oxycodone

A semisynthetic opioid of formula C18H21NO4 that is derived from thebaine.  It is a moderately potent opioid analgesic, generally used for relief of moderate to severe pain.


name: IDE_MOUSE Insulin-degrading enzyme (sprot)

description: An insulin-degrading enzyme that is encoded in the genome of mouse.


A member of the class of pyrimidobenzodiazepines that is 5,11-dimethylpyrimido[4,5-b][1,4]benzodiazepin-6-one carrying at C-2 on the pyrimidine ring a 4-[(4-methylpiperazin-1-yl)piperidine-1-carbonyl]-2-methoxyanilino substituent. It is an inhibitor of the Parkinson's disease kinase LRRK2.


A monocarboxylic acid amide resulting from the formal condensation of the carboxy group of 4-{[5-chloro-4-(methylamino)pyrimidin-2-yl]amino}-3-methoxybenzoic acid with the amino group of morpholine. It is an inhibitor of leucine-rich repeat kinase 2 (LRRK2).


name: KMT2A_HUMAN Histone-lysine N-methyltransferase 2A (sprot)

description: A histone-lysine N-methyltransferase 2A that is encoded in the genome of human.


name: R1AB_SARS2 Replicase polyprotein 1ab (sprot)


usnic acid

A member of the class of  dibenzofurans that is dibenzo[b,d]furan-1(9bH)-one substituted by acetyl groups at positions 2 and 6, hydroxy groups at positions 3 and 7 and methyl groups at positions 8 and 9b.


name: F16P1_PIG Fructose-1,6-bisphosphatase 1 (sprot)

description: A fructose-1,6-bisphosphatase 1 that is encoded in the genome of pig.


name: F16P1_HUMAN Fructose-1,6-bisphosphatase 1 (sprot)

description: A fructose-1,6-bisphosphatase 1 that is encoded in the genome of human.


name: 4-[6-Amino-5-(pyridin-4-ylcarbamoyl)-pyridin-3-yl]-benzoic acid methyl ester


tovorafenib

A 1,3-thiazolecarboxamide that is 2-[(1R)-1-aminoethyl]-1,3-thiazole-5-carboxylic acid in which the carboxy group undergoes formal condensation with the amino group of 5-chloro-4-(trifluoromethyl)pyridin-2-amine and in which the amino group undergoes formal condensation with the carboxy group of 6-amino-5-chloropyrimidine-4-carboxylic acid. It is a pan-RAF kinase inhibitor which is currently in clinical development for the treatment of radiographically recurrent or progressive low-grade glioma in children and young adults.


A member of the class of diamino-1,3,5-triazines that is 1,3,5-triazine-2,4-diamine in which the amino groups at positions 2 and 4 are respectively carrying 2-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl and 2-(propan-2-ylsulfonyl)phenyl substituents. It is a potent inhibitor of anaplastic lymphoma kinase (ALK), Ack and ROS1 activity (IC50 values are 3.5, 5.8 and 8.9 nM respectively) and exhibits anti-cancer properties.


regorafenib

A pyridinecarboxamide obtained by condensation of 4-[4-({[4-chloro-3-(trifluoromethyl)phenyl]carbamoyl}amino)-3-fluorophenoxy]pyridine-2-carboxylic acid with methylamine. Used for for the treatment of metastatic colorectal cancer in patients who have previously received chemotherapy, anti-EGFR or anti-VEGF therapy.


ritlecitinib

A pyrrolopyrimidine that is 7H-pyrrolo[2,3-d]pyrimidine substituted at position 4 by a [(3R,6S)-6-methyl-1-(prop-2-enoyl)piperidin-3-yl]amino group. It is a dual inhibitor of Janus kinase 3 and the TEC family of tyrosine kinases.


chlorogenic acid

A cinnamate ester obtained by formal condensation of the carboxy group of trans-caffeic acid with the 3-hydroxy group of quinic acid. It is an intermediate metabolite in the biosynthesis of lignin.


name: NOTC1_HUMAN Neurogenic locus notch homolog protein 1 (sprot)

description: A neurogenic locus notch homolog protein 1 that is encoded in the genome of human.


name: NOTC3_HUMAN Neurogenic locus notch homolog protein 3 (sprot)

description: A neurogenic locus notch homolog protein 3 that is encoded in the genome of human.


name: SUH_HUMAN Recombining binding protein suppressor of hairless (sprot)

description: A recombining binding protein suppressor of hairless that is encoded in the genome of human.


name: AADB1_KLEPN 2''-aminoglycoside nucleotidyltransferase (sprot)

description: A protein that is a translation product of the aadB gene in Klebsiella pneumoniae.


niraparib

A 2-[4-(piperidin-3-yl)phenyl]-2H-indazole-7-carboxamide that has S-configuration. It is a potent inhibitor of PARP1 and PARP2 (IC50 of 3.8 and 2.1 nM, respectively) and approved as a first-line maintenance treatment for women with advanced ovarian cancer after responding to platinum-based chemotherapy.


rucaparib

A member of the class of azepinoindoles that is 1,3,4,5-tetrahydro-6H-azepino[5,4,3-cd]indol-6-one carrying additional 4-[(methylamino)methyl]phenyl and fluoro substituents at positions 2 and 8 respectively. It is an inhibitor of poly (ADP-ribose) polymerase and is used (as the camsylate salt) as monotherapy for advanced ovarian cancer and deleterious germline or somatic BRCA mutation.


name: G6PE_HUMAN GDH/6PGL endoplasmic bifunctional protein (sprot)

description: A GDH/6PGL endoplasmic bifunctional protein that is encoded in the genome of human.


name: 2-[(6-Cyclohexyl-pyridine-2-carbonyl)-amino]-2-methyl-propionic acid methyl ester


name: 2-{[6-Cyclopropylmethoxy-5-(tetrahydro-pyran-4-yl)-pyridine-2-carbonyl]-amino}-2-methyl-propionic acid methyl ester


name: 2-{[6-Cyclopropylmethoxy-5-(1H-pyrazol-3-yl)-pyridine-2-carbonyl]-amino}-2-methyl-propionic acid methyl ester


name: 2-[(6-Cyclopropylmethoxy-5-pyrrolidin-1-yl-pyridine-2-carbonyl)-amino]-2-methyl-propionic acid methyl ester


name: 2-[(6-Cyclohexyl-pyridine-2-carbonyl)-amino]-cyclohexanecarboxylic acid methyl ester


name: 2-{[5-Cyclopropyl-6-(tetrahydro-furan-2-ylmethoxy)-pyridine-2-carbonyl]-amino}-2-ethyl-butyric acid methyl ester


name: 2-Ethyl-2-{[6-(tetrahydro-pyran-4-ylmethoxy)-5-trifluoromethyl-pyridine-2-carbonyl]-amino}-butyric acid methyl ester


name: (S)-2-[(5-Cyclopropyl-6-cyclopropylmethoxy-pyridine-2-carbonyl)-amino]-3,3-dimethyl-butyric acid methyl ester


name: 2-[(6-Cyclopropylmethoxy-5-trifluoromethyl-pyridine-2-carbonyl)-amino]-2-ethyl-butyric acid methyl ester


name: 2-[(5-Cyclopropyl-6-cyclopropylmethoxy-pyridine-2-carbonyl)-amino]-2-ethyl-butyric acid methyl ester


name: 2-Ethyl-2-{[6-(tetrahydro-furan-2-ylmethoxy)-5-trifluoromethyl-pyridine-2-carbonyl]-amino}-butyric acid ethyl ester


name: 2-[(5-Cyclopropyl-6-cyclopropylmethoxy-pyridine-2-carbonyl)-amino]-2-ethyl-butyric acid ethyl ester


name: (S)-3-Cyclopropyl-2-[(5-cyclopropyl-6-cyclopropylmethoxy-pyridine-2-carbonyl)-amino]-propionic acid methyl ester


name: 2-[(5-Bromo-6-cyclopropylmethoxy-pyridine-2-carbonyl)-amino]-2-ethyl-butyric acid ethyl ester


name: 2-{[6-Cyclopropylmethoxy-5-(3,3-difluoro-azetidin-1-yl)-pyridine-2-carbonyl]-amino}-2-ethyl-butyric acid ethyl ester


name: (S)-2-[(5-Cyclopropyl-6-cyclopropylmethoxy-pyridine-2-carbonyl)-amino]-4-methyl-pentanoic acid methyl ester


name: 2-[(6-Cyclopropylmethoxy-5-pyrrolidin-1-yl-pyridine-2-carbonyl)-amino]-2-ethyl-butyric acid ethyl ester


name: 2-{[5-Cyclopropyl-6-(2-methyl-propane-1-sulfonyl)-pyridine-2-carbonyl]-amino}-2-ethyl-butyric acid ethyl ester


name: (S)-2-[(5-Cyclopropyl-6-cyclopropylmethoxy-pyridine-2-carbonyl)-amino]-4-methyl-pentanoic acid tert-butyl ester


name: DYRA_STAAU Dihydrofolate reductase type 1 from Tn4003 (sprot)


ENPL_HUMAN Endoplasmin (sprot)

An endoplasmin that is encoded in the genome of human.


name: TA2R8_HUMAN Taste receptor type 2 member 8 (sprot)

description: A taste receptor type 2 member 8 that is encoded in the genome of human.


name: GYS1_HUMAN Glycogen [starch] synthase, muscle (sprot)

description: A glycogen [starch] synthase, muscle that is encoded in the genome of human.


name: US9290490, Example 5, Step 3 (trans isomer)


LACCACID ACID A

A tetrahydroxyanthraquinone that is that is 3,5,6,8-tetrahydroxy-9,10-anthraquinone substituted by two carboxy groups at positions 1 and 2 as well as a 5-(2-acetamidoethyl)-2-hydroxyphenyl group at position 7. The major component of LAC dye together with laccaic acids B, C and D


name: MTSI_SPISQ Orphan methyltransferase M.SssI (sprot)

description: A DNA restriction-modification methylase that is a translation product of the sssIM gene in Spiroplasma monobiae.


AMPELOPSIN

An optically active form of dihydromyricetin having (2R,3R)-configuration.


(+)-TAXIFOLIN

A taxifolin that has (2R,3R)-configuration.


name: CHDC_STAAB Coproheme decarboxylase (sprot)


PALMITOYL GLYCINE

An N-acylglycine in which the acyl group is specified as hexadecanoyl (palmitoyl).


name: CPXB_PRIM2 Bifunctional cytochrome P450/NADPH--P450 reductase (sprot)


name: FABP4_HUMAN Fatty acid-binding protein, adipocyte (sprot)

description: A fatty acid-binding protein, adipocyte that is encoded in the genome of human.


name: FABP5_HUMAN Fatty acid-binding protein 5 (sprot)

description: A fatty acid-binding protein 5 that is encoded in the genome of human.


warfarin

A racemate comprising equal amounts of (R)- and (S)-warfarin. Extensively used as both an anticoagulant drug and as a pesticide against rats and mice.


name: VKOR1_HUMAN Vitamin K epoxide reductase complex subunit 1 (sprot)

description: A vitamin K epoxide reductase complex subunit 1 that is encoded in the genome of human.


name: VKORL_HUMAN Vitamin K epoxide reductase complex subunit 1-like protein 1 (sprot)

description: A vitamin K epoxide reductase complex subunit 1-like protein 1 that is encoded in the genome of human.


name: VKOR1_RAT Vitamin K epoxide reductase complex subunit 1 (sprot)

description: A vitamin K epoxide reductase complex subunit 1 that is encoded in the genome of rat.


name: VKORL_RAT Vitamin K epoxide reductase complex subunit 1-like protein 1 (sprot)

description: A vitamin K epoxide reductase complex subunit 1-like protein 1 that is encoded in the genome of rat.


NAD

Abbreviation for nicotinamide-adenine dinucleotide when its oxidation state is unknown or unspecified. It is used in metabolic pathways like glycolysis and citric acid cycle.


name: IPPK_ARATH Inositol-pentakisphosphate 2-kinase (sprot)

description: A protein that is a translation product of the IPK1 gene in Arabidopsis thaliana.


Octaanion of 1D-myo-inositol 1,4,5,6-tetrakisphosphate arising from global deprotonation of the phosphate OH groups.


Octaanion of 1D-myo-inositol 3,4,5,6-tetrakisphosphate arising from global deprotonation of the acidic phosphate OH groups.


name: FANCJ_HUMAN Fanconi anemia group J protein (sprot)

description: A Fanconi anemia group J protein that is encoded in the genome of human.


name: DING_ECOLI ATP-dependent DNA helicase DinG (sprot)

description: An ATP-dependent DNA helicase DinG that is encoded in the genome of Escherichia coli K-12.


name: PRP4K_HUMAN Serine/threonine-protein kinase PRP4 homolog (sprot)

description: A serine/threonine-protein kinase PRP4 that is encoded in the genome of human.


name: CLPC1_MYCTU ATP-dependent Clp protease ATP-binding subunit ClpC1 (sprot)


name: GCYA1_HUMAN Guanylate cyclase soluble subunit alpha-1 (sprot)

description: A guanylate cyclase soluble subunit alpha-1 that is encoded in the genome of human.


CTNB1_HUMAN Catenin beta-1 (sprot)

A catenin beta-1 that is encoded in the genome of human.


name: SGK1_MOUSE Serine/threonine-protein kinase Sgk1 (sprot)

description: A serine/threonine-protein kinase Sgk1 that is encoded in the genome of mouse.


name: HISJ_ECOLI Histidine-binding periplasmic protein (sprot)

description: A histidine-binding periplasmic protein that is encoded in the genome of Escherichia coli K-12.


name: CP51A_HUMAN Lanosterol 14-alpha demethylase (sprot)

description: A lanosterol 14-alpha demethylase that is encoded in the genome of human.


tetrabenazine

A benzoquinolizine that is 1,2,3,4,4a,9,10,10a-octahydrophenanthrene in which the carbon at position 10a is replaced by a nitrogen and which is substituted by an isobutyl group at position 2, an oxo group at position 3, and methoxy groups at positions 6 and 7.


name: VMAT2_RAT Synaptic vesicular amine transporter (sprot)

description: A synaptic vesicular amine transporter that is encoded in the genome of rat.


name: MOT1_RAT Monocarboxylate transporter 1 (sprot)

description: A monocarboxylate transporter 1 that is encoded in the genome of rat.


QUINALDINE BLUE

A cationic C3 cyanine dye having quinolin-2-yl units at each end.


C3-indocyanine cation

The cationic form of a C3 cyanine dye having 1-ethyl-3,3-dimethylindoleinine units at each end.


gentian violet

An iminium ion that is malachite green cation in which the hydrogen at the para- psition of the monosubstituted phenyl group is replaced by a dimethylamino group.


BRILLIANT GREEN

An iminium ion obtained by dimethylation of the imino group of 4-{[4-(dimethylamino)phenyl](phenyl)methylene}cyclohexa-2,5-dien-1-imine. Used in the form of its chloride salt as a green-coloured dye.


name: ST1A1_HUMAN Sulfotransferase 1A1 (sprot)

description: A sulfotransferase 1A1 that is encoded in the genome of human.


name: ST2A1_HUMAN Sulfotransferase 2A1 (sprot)

description: A sulfotransferase 2A1 that is encoded in the genome of human.


name: DGAT2_HUMAN Diacylglycerol O-acyltransferase 2 (sprot)

description: A diacylglycerol O-acyltransferase 2 that is encoded in the genome of human.


name: PK3CB_MOUSE Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform (sprot)

description: A phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform that is encoded in the genome of mouse.


name: PK3CG_MOUSE Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform (sprot)

description: A phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform that is encoded in the genome of mouse.


name: PK3CD_MOUSE Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform (sprot)

description: A phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform that is encoded in the genome of mouse.


name: PRKDC_MOUSE DNA-dependent protein kinase catalytic subunit (sprot)

description: A DNA-dependent protein kinase catalytic subunit that is encoded in the genome of mouse.


SALICYLHYDROXAMIC ACID

A hydroxamic acid that is N-hydroxybenzamide carrying a phenolic hydroxy group at position 2.


PERT_HUMAN Thyroid peroxidase (sprot)

A thyroid peroxidase that is encoded in the genome of human.


PERL_BOVIN Lactoperoxidase (sprot)

A lactoperoxidase that is encoded in the genome of cow.


name: PPP5_HUMAN Serine/threonine-protein phosphatase 5 (sprot)

description: A serine/threonine-protein phosphatase 5 that is encoded in the genome of human.


name: HLNO_PAENI (S)-6-hydroxynicotine oxidase (sprot)


name: MBOA4_HUMAN Ghrelin O-acyltransferase (sprot)

description: A ghrelin O-acyltransferase that is encoded in the genome of human.


IOTYROSINE

The monoiodotyrosine that is L-tyrosine carrying an iodo-substituent at position C-3 of the benzyl group.


name: IYD1_HUMAN Iodotyrosine deiodinase 1 (sprot)

description: An iodotyrosine deiodinase 1 that is encoded in the genome of human.


name: IYD_HALH1 Iodotyrosine deiodinase (sprot)


name: {[8-((R)-1-phenyl-propylcarbamoyl)-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]oxazine-6-carbonyl]-amino}-acetic acid ethyl ester


name: MTIP_PSEAE S-methyl-5'-thioinosine phosphorylase (sprot)


name: KPCI_HUMAN Protein kinase C iota type (sprot)

description: A protein kinase C iota type that is encoded in the genome of human.


name: KAP0_HUMAN cAMP-dependent protein kinase type I-alpha regulatory subunit (sprot)

description: A cAMP-dependent protein kinase type I-alpha regulatory subunit that is encoded in the genome of human.


name: PAX2_HUMAN Paired box protein Pax-2 (sprot)

description: A paired box protein Pax-2 that is encoded in the genome of human.


name: FOXM1_HUMAN Forkhead box protein M1 (sprot)

description: A forkhead box protein M1 that is encoded in the genome of human.


JASMONIC ACID

An oxo monocarboxylic acid that is (3-oxocyclopentyl)acetic acid substituted by a (2Z)-pent-2-en-1-yl group at position 2 of the cyclopentane ring.


medroxyprogesterone

An acetate ester resulting from the formal condensation of the 17alpha-hydroxy group of medroxyprogesterone with the carboxy group of acetic acid. A widely used progestin in menopausal hormone therapy and in progestogen-only birth control.


diphenylamine-2-carboxylic acid

An aminobenzoic acid that is the N-phenyl derivative of  anthranilic acid. It acts as a parent skeleton for the synthesis of several non-steroidal anti-inflammatory drugs.


name: AOC1_HUMAN Diamine oxidase [copper-containing] (sprot)

description: An amiloride-sensitive amine oxidase [copper-containing] that is encoded in the genome of human.


varenicline

An organic heterotetracyclic compound that acts as a partial agonist for nicotinic cholinergic receptors and is used (in the form of its tartate salt) as an aid to giving up smoking.


name: URE23_HELPY Urease subunit alpha (sprot)


name: {tert-Butyl-[6-cyclopropylmethoxy-5-(3,3-difluoro-azetidin-1-yl)-pyridine-2-carbonyl]-amino}-acetic acid ethyl ester


name: 1-[6-Cyclopropylmethoxy-5-(3,3-difluoro-azetidin-1-yl)-pyridine-2-carbonyl]-pyrrolidine-2-carboxylic acid methyl ester


name: 4-[6-Cyclopropylmethoxy-5-(3,3-difluoro-azetidin-1-yl)-pyridine-2-carbonyl]-piperazine-1-carboxylic acid benzyl ester


name: 1-[5-Cyclopropyl-6-(4-fluoro-benzyl)-pyridine-2-carbonyl]-1,8-diaza-spiro[4.5]decane-8-carboxylic acid tert-butyl ester


name: ACHB2_RAT Neuronal acetylcholine receptor subunit beta-2 (sprot)

description: A neuronal acetylcholine receptor subunit beta-2 that is encoded in the genome of rat.


name: CXCR4_HUMAN C-X-C chemokine receptor type 4 (sprot)

description: A C-X-C chemokine receptor type 4 that is encoded in the genome of human.


name: S1PR1_MOUSE Sphingosine 1-phosphate receptor 1 (sprot)

description: A sphingosine 1-phosphate receptor 1 that is encoded in the genome of mouse.


bentranil

A benzoxazine that is 4H-3,1-benzoxazin-4-one substituted by a phenyl group at position 2. It is a postemergence herbicide used for the control of annual weeds in cereal crops, maize, and rice.


rilpivirine

An aminopyrimidine that is pyrimidine-2,4-diamine in which the amino groups at positions 2 and 4 are substituted by 4-cyanophenyl and 4-[(E)-2-cyanovinyl]-2,6-dimethylphenyl groups respectively. Used for treatment of HIV.


name: PPBT_BOVIN Alkaline phosphatase, tissue-nonspecific isozyme (sprot)

description: An alkaline phosphatase, tissue-nonspecific isozyme that is encoded in the genome of cow.


levamisole

A 6-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole that has S configuration. It is used (generally as the monohydrochloride salt) to treat parasitic worm infections in pigs, sheep and cattle and was formerly used in humans as an adjuvant to chemotherapy for the treatment of various cancers. It is also widely used as an adulterant to coccaine.


name: PPBI_BOVIN Intestinal-type alkaline phosphatase (sprot)


L-phenylalanine

The L-enantiomer of phenylalanine.


D-SACCHARIC ACID 1,4-LACTONE

A delta-lactone that is D-glucono-1,4-lactone in which the hydroxy group at position 6 has been oxidised to the corresponding carboxylic acid.


5NTD_HUMAN 5'-nucleotidase (sprot)

A 5'-nucleotidase that is encoded in the genome of human.


name: (Z)-4-(2-((E)-4-(3,4-dimethoxyphenyl)-1-morpholino-2-oxobut-3-enylidene) hydrazinyl) benzenesulfonamide (4e)


name: 2-Methyl-4-(2-oxo-2-phenyl-ethyl)-5-phenyl-furan-3-carboxylic acid methyl ester (3a)


name: 2-Methyl-4-(2-oxo-2-phenyl-ethyl)-5-phenyl-furan-3-carboxylic acid ethyl ester (3b)


name: 2-Methyl-4-(2-oxo-2-p-tolyl-ethyl)-5-p-tolyl-furan-3-carboxylic acid ethyl ester (3d)


name: 5-(4-Bromo-phenyl)-4[2-(4-bromo-phenyl)-2-oxo-ethyl]-2-methyl-furan-3-carboxylic acid methyl ester (3e)


name: 5-(4-Bromo-phenyl)-4[2-(4-bromo-phenyl)-2-oxo-ethyl]-2-methyl-furan-3-carboxylic acid ethyl ester (3f)


name: 5-(4-Chloro-phenyl)-4[2-(4-chloro-phenyl)-2-oxo-ethyl]-2-methyl-furan-3-carboxylic acid methyl ester (3g)


name: 5-(4-Chloro-phenyl)-4[2-(4-chloro-phenyl)-2-oxo-ethyl]-2-methyl-furan-3-carboxylic acid ethyl ester (3h)


name: 5-(3-Chloro-4-methyl-phenyl)-4-[2-(3-chloro-4-methyl-phenyl)-2-oxo-ethyl)-2-methyl-furan-3-carboxylic acid methyl ester (3i)


name: 5-(3-Chloro-4-methyl-phenyl)-4-[2-(3-chloro-4-methyl-phenyl)-2-oxo-ethyl)-2-methyl-furan-3-carboxylic acid methyl ester (3j)


arachidonic acid

A long-chain fatty acid that is a C20, polyunsaturated fatty acid having four (Z)-double bonds at positions 5, 8, 11 and 14.


name: UPAR_HUMAN Urokinase plasminogen activator surface receptor (sprot)

description: A urokinase plasminogen activator surface receptor that is encoded in the genome of human.


name: B4GT1_BOVIN Beta-1,4-galactosyltransferase 1 (sprot)


meclofenamic acid(1-)

A monocarboxylic acid anion resulting from the removal of the proton from the carboxy group of meclofenamic acid. The major species at pH 7.3.


name: N-(3-fluoro-4-((2-(4-(3-(4-methylpiperazin-1-yl) propyl)-4H-1,2,4-triazol-3-yl) pyridin-4-yl) oxy) phenyl)-1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carboxamide (12d)


name: 5-Ethoxy-6-morpholin-4-yl-2-[4-(3-phenyl-ureido)-phenyl]-pyrimidine-4-carboxylic acid ethyl ester


name: 5-Ethoxy-2-[4-(3-ethyl-ureido)-phenyl]-6-morpholin-4-yl-pyrimidine-4-carboxylic acid ethyl ester


name: 5-Ethoxy-2-[4-(3-methyl-ureido)-phenyl]-6-morpholin-4-yl-pyrimidine-4-carboxylic acid ethyl ester


name: GAL4_YEAST Regulatory protein GAL4 (sprot)

description: A protein that is a translation product of the GAL4 gene in yeast.


name: DPOL_HCMVA DNA polymerase catalytic subunit (sprot)


name: ANM5_HUMAN Protein arginine N-methyltransferase 5 (sprot)

description: A protein arginine N-methyltransferase 5 that is encoded in the genome of human.


The (S)-enantiomer of flavanone.


name: LUCI_OPLGR Oplophorus-luciferin 2-monooxygenase catalytic subunit (sprot)


3-sulfopyruvic acid

A carboxyalkanesulfonic acid comprising pyruvic acid with a sulfo group attached at the C-3 position.


phosphoenolpyruvic acid

A monocarboxylic acid that is acrylic acid substituted by a phosphonooxy group at position 2. It is a metabolic intermediate in pathways like glycolysis and gluconeogenesis.


EZRI_HUMAN Ezrin (sprot)

An ezrin that is encoded in the genome of human.


name: LTC4S_HUMAN Leukotriene C4 synthase (sprot)

description: A leukotriene C4 synthase that is encoded in the genome of human.


name: SOX18_MOUSE Transcription factor SOX-18 (sprot)

description: A transcription factor SOX-18 that is encoded in the genome of mouse.


felbinac

A monocarboxylic acid in which one of the alpha-hydrogens is substituted by a biphenyl-4-yl group. An active metabolite of fenbufen, it is used as a topical medicine to treat muscle inflammation and arthritis.


naproxen

A methoxynaphthalene that is 2-methoxynaphthalene substituted by a carboxy ethyl group at position 6. Naproxen is a non-steroidal anti-inflammatory drug commonly used for the reduction of pain, fever, inflammation  and stiffness caused by conditions such as osteoarthritis, kidney stones, rheumatoid arthritis, psoriatic arthritis, gout, ankylosing spondylitis, menstrual cramps, tendinitis, bursitis, and for the treatment of primary dysmenorrhea. It works by inhibiting both the COX-1 and COX-2 enzymes.


tiaprofenic acid

An aromatic ketone that is thiophene substituted at C-2 by benzoyl and at C-4 by a 1-carboxyethyl group.


MGA_HUMAN Maltase-glucoamylase (sprot)

A maltase-glucoamylase that is encoded in the genome of human.


name: RIOX2_HUMAN Ribosomal oxygenase 2 (sprot)

description: A ribosomal oxygenase 2 that is encoded in the genome of human.


name: RIOX1_HUMAN Ribosomal oxygenase 1 (sprot)

description: A ribosomal oxygenase 1 that is encoded in the genome of human.


name: HIF1N_HUMAN Hypoxia-inducible factor 1-alpha inhibitor (sprot)

description: A hypoxia-inducible factor 1-alpha inhibitor that is encoded in the genome of human.


name: IRS1_HUMAN Insulin receptor substrate 1 (sprot)

description: An insulin receptor substrate 1 that is encoded in the genome of human.


name: LPAR1_HUMAN Lysophosphatidic acid receptor 1 (sprot)

description: A lysophosphatidic acid receptor 1 that is encoded in the genome of human.


name: LPAR3_HUMAN Lysophosphatidic acid receptor 3 (sprot)

description: A lysophosphatidic acid receptor 3 that is encoded in the genome of human.


name: NAAA_RAT N-acylethanolamine-hydrolyzing acid amidase (sprot)

description: An N-acylethanolamine-hydrolyzing acid amidase that is encoded in the genome of rat.


name: UBP2_HUMAN Ubiquitin carboxyl-terminal hydrolase 2 (sprot)

description: A ubiquitin carboxyl-terminal hydrolase 2 that is encoded in the genome of human.


name: KMT5B_HUMAN Histone-lysine N-methyltransferase KMT5B (sprot)

description: A histone-lysine N-methyltransferase KMT5B that is encoded in the genome of human.


name: KMT5C_HUMAN Histone-lysine N-methyltransferase KMT5C (sprot)

description: A histone-lysine N-methyltransferase KMT5C that is encoded in the genome of human.


EED_HUMAN Polycomb protein EED (sprot)

A polycomb protein EED that is encoded in the genome of human.


name: CSN5_HUMAN COP9 signalosome complex subunit 5 (sprot)

description: A COP9 signalosome complex subunit 5 that is encoded in the genome of human.


name: STABP_HUMAN STAM-binding protein (sprot)

description: A STAM-binding protein that is encoded in the genome of human.


name: BRCC3_HUMAN Lys-63-specific deubiquitinase BRCC36 (sprot)

description: A lys-63-specific deubiquitinase BRCC36 that is encoded in the genome of human.


name: LGUL_HUMAN Lactoylglutathione lyase (sprot)

description: A lactoylglutathione lyase that is encoded in the genome of human.


codeine

A  morphinane alkaloid found in the opium poppy, Papaver somniferum var. album; has analgesic, anti-tussive and anti-diarrhoeal properties.


name: MRGX2_HUMAN Mas-related G-protein coupled receptor member X2 (sprot)

description: A Mas-related G-protein coupled receptor X2 that is encoded in the genome of human.


hydrocodone

A morphinane-like compound that is a semi-synthetic opioid synthesized from codeine.


NORCODEINE

A morphinane-like compound that is the N-demethylated derivative of codeine.


name: LIPP_PIG Pancreatic triacylglycerol lipase (sprot)


A taxane diterpenoid that consists of paclitaxel bearing an additional hydroxy substituent at the 6alpha-position.


ALPHA-HYDROXY-MIDAZOLAM

An imidazobenzodiazepine that is midazolam in which one of the hydrogens of the methyl group is substituted by a hydroxy group. It is the major metabolite of the anesthetic, midazolam.


A 17beta-hydroxy steroid that is testosterone bearing an additional hydroxy substituent at the 6beta-position.


name: DUS5_HUMAN Dual specificity protein phosphatase 5 (sprot)

description: A dual specificity protein phosphatase 5 that is encoded in the genome of human.


name: EHMT2_HUMAN Histone-lysine N-methyltransferase EHMT2 (sprot)

description: A histone-lysine N-methyltransferase, H3 lysine-9 specific 3 that is encoded in the genome of human.


name: TRMD_HAEIN tRNA (guanine-N(1)-)-methyltransferase (sprot)


A  monocarboxylic acid amide resulting from the formal condensation of the carboxy group of 6-aminonicotinic acid with ammonia. An inhibitor of the NADP(+)-dependent enzyme, 6-phosphogluconate dehydrogenase, it interferes with glycolysis, resulting in ATP depletion and synergizes with DNA-crosslinking chemotherapy drugs, such as cisplatin, in killing cancer cells.


name: Y3332_PSEAE Uncharacterized PhzA/B-like protein PA3332 (sprot)


ursodeoxycholate

A bile acid anion that is the conjugate base of ursodeoxycholic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.


formestane

A 17-oxo steroid that is androst-4-ene-3,17-dione in which the hydrogen at position 4 is replaced by a hydroxy group. Formestane was the first selective, type I steroidal aromatase inhibitor, suppressing oestrogen production from anabolic steroids or prohormones. It was formerly used in the treatment of oestrogen-receptor positive breast cancer in post-meopausal women. As it has poor oral bioavailability, it had to be administered by (fortnightly) intramuscular injection. It fell out of use with the subsequent development of cheaper, orally active aromatase inhibitors. Formestane is listed by the World Anti-Doping Agency as a substance prohibited from use by athletes.


DIGOXIGENIN

A hydroxy steroid that consists of 5beta-cardanolide having a double bond at the 20(22)-position as well as hydroxy groups at the 3beta-, 12beta- and 14beta-positions. It has been isolated from the plant species of the genus Digitalis.


The simplest member of the class  fluoren-9-ones that is 9H-fluorene bearing an oxo substituent at position 9.


A benzenetriol that is benzophenone in which one of the phenyl groups is substituted by hydroxy groups at positions 2, 3, and 4. It is a redox mediator.


ERIODICTYOL

A tetrahydroxyflavanone that is flavanone substituted by hydroxy groups at positions 5, 7, 3' and 4' respectively.


name: SIGB_MYCTU RNA polymerase sigma factor SigB (sprot)


URSOLIC ACID

A pentacyclic triterpenoid that is urs-12-en-28-oic acid substituted by a beta-hydroxy group at position 3.


kaempferol 7-O-beta-D-glucopyranoside

A kaempferol O-glucoside that is  kaempferol attached to a beta-D-glucopyranosyl moiety at position 7 via a glycosidic linkage.


kaempferol 7-O-glucuronide

A kaempferol O-glucuronide that is kaempferol with a beta-D-glucosiduronic acid residue attached at the 7-position.


ASTRAGALIN

A kaempferol O-glucoside in which a glucosyl residue is attached at position 3 of kaempferol via a beta-glycosidic linkage.


APIGETRIN

A glycosyloxyflavone that is apigenin substituted by a beta-D-glucopyranosyl moiety at position 7 via a glycosidic linkage.


luteolin 7-O-beta-D-glucosiduronic acid

A luteolin glucosiduronic acid consisting of luteolin having a beta-D-glucosiduronic acid residue attached at the 7-position.


name: Luteolin 7-O-beta-D-glucuronide methyl ester (15)


name: Luteolin 7-O-beta-D-glucuronide butyl ester (16)


name: dihydrodehydrodiconifeyl alcohol 9'-O-beta-D-glucose (19)


TLR7_HUMAN Toll-like receptor 7 (sprot)

A Toll-like receptor 7 that is encoded in the genome of human.


name: 4-[2,6-Bis-((R)-3-methyl-morpholin-4-yl)-9H-purin-8-yl]-1H-indole-6-carboxylic acid methyl ester


dichloroacetic acid

An organochlorine compound comprising acetic acid carrying two chloro substituents at the 2-position. It occurs in nature in seaweed, Asparagopsis taxiformis.


name: PDK4_HUMAN [Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 4, mitochondrial (sprot)

description: A [pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 4, mitochondrial that is encoded in the genome of human.


name: PDK3_HUMAN [Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 3, mitochondrial (sprot)

description: A [pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 3, mitochondrial that is encoded in the genome of human.


BLO1_ECOLX Beta-lactamase OXA-1 (sprot)

A protein that is a translation product of any of the plasmid-encoded copies of the bla gene in Escherichia coli.


name: 8ODP_HUMAN Oxidized purine nucleoside triphosphate hydrolase (sprot)

description: An oxidized purine nucleoside triphosphate hydrolase that is encoded in the genome of human.


trans-zeatin

The trans-isomer of zeatin.


name: MDR1A_MOUSE ATP-dependent translocase ABCB1 (sprot)

description: An ATP-dependent translocase ABCB1a that is encoded in the genome of mouse.


name: XIAP_MOUSE E3 ubiquitin-protein ligase XIAP (sprot)

description: A baculoviral IAP repeat-containing protein 4 that is encoded in the genome of mouse.


name: PRDM9_HUMAN Histone-lysine N-methyltransferase PRDM9 (sprot)

description: A histone-lysine N-methyltransferase PRDM9 that is encoded in the genome of human.


name: FABP5_MOUSE Fatty acid-binding protein 5 (sprot)

description: A fatty acid-binding protein 5 that is encoded in the genome of mouse.


GSK-3 inhibitor XIII

A member of the class of aromatic amines that is ammonia with two of the hydrogens replaced by 5-methylpyrazol-3-yl and 2-phenylquinazolin-4-yl groups.


linoleic acid

An octadecadienoic acid in which the two double bonds are at positions 9 and 12 and have Z (cis) stereochemistry.


palmitoleic acid

A hexadec-9-enoic acid in which the double bond at position C-9 has cis configuration.


palmitic acid

A straight-chain, sixteen-carbon, saturated long-chain fatty acid.


BGAL_HUMAN Beta-galactosidase (sprot)

A eukaryotic-type beta-galactosidase that is encoded in the genome of human.


D-GALACTOSE

A galactopyranose having D-configuration.


name: LPXA_ECOLI Acyl-[acyl-carrier-protein]--UDP-N-acetylglucosamine O-acyltransferase (sprot)

description: An acyl-[acyl-carrier-protein]--UDP-N-acetylglucosamine O-acyltransferase that is encoded in the genome of Escherichia coli K-12.


name: LPXD_ECOLI UDP-3-O-(3-hydroxymyristoyl)glucosamine N-acyltransferase (sprot)

description: A UDP-3-O-(3-hydroxymyristoyl)glucosamine N-acyltransferase that is encoded in the genome of Escherichia coli K-12.


name: OSBP2_HUMAN Oxysterol-binding protein 2 (sprot)

description: An oxysterol-binding protein 2 that is encoded in the genome of human.


PROK2_HUMAN Prokineticin-2 (sprot)

A prokineticin-2 that is encoded in the genome of human.


name: SIR6_HUMAN NAD-dependent protein deacylase sirtuin-6 (sprot)

description: An NAD-dependent protein deacylase sirtuin-6 that is encoded in the genome of human.


pyrazinamide

A monocarboxylic acid amide resulting from the formal condensation of the carboxy group of pyrazinoic acid (pyrazine-2-carboxylic acid) with ammonia. A prodrug for pyrazinoic acid, pyrazinecarboxamide is used as part of multidrug regimens for the treatment of tuberculosis.


PYRAZINOIC ACID

The parent compound of the class of pyrazinecarboxylic acids, that is pyrazine bearing a single carboxy substituent. The active metabolite of the antitubercular drug pyrazinamide.


name: ISPH_PSEAE 4-hydroxy-3-methylbut-2-enyl diphosphate reductase (sprot)


name: ISPH_ECOLI 4-hydroxy-3-methylbut-2-enyl diphosphate reductase (sprot)

description: A 4-hydroxy-3-methylbut-2-enyl diphosphate reductase that is encoded in the genome of Escherichia coli K-12.


name: ISPH_AQUAE 4-hydroxy-3-methylbut-2-enyl diphosphate reductase (sprot)


name: ETHR_MYCTU HTH-type transcriptional regulator EthR (sprot)

description: A protein that is a translation product of the ethR gene in Mycobacterium tuberculosis H37Rv.


name: RPOB_ECOLI DNA-directed RNA polymerase subunit beta (sprot)

description: A DNA-directed RNA polymerase subunit beta that is encoded in the genome of Escherichia coli K-12.


name: RPOB_SHISS DNA-directed RNA polymerase subunit beta (sprot)


rifamycin SV

A member of the class of rifamycins that exhibits antibiotic and antitubercular properties.


name: NHRF1_HUMAN Na(+)/H(+) exchange regulatory cofactor NHE-RF1 (sprot)

description: A Na(+)/H(+) exchange regulatory cofactor NHE-RF1 that is encoded in the genome of human.


aclidinium

A carboxylic ester obtained by formal condensation between the carboxy group of 2-hydroxy(di-2-thienyl)acetic acid and the hydroxy group of N-(3-phenoxypropyl)-3-quinuclidinol. Used as its bromide salt for the long-term maintenance treatment of bronchospasm associated with chronic obstructive pulmonary disease (COPD).


name: MC5R_MOUSE Melanocortin receptor 5 (sprot)

description: A melanocortin receptor 5 that is encoded in the genome of mouse.


name: PTN9_HUMAN Tyrosine-protein phosphatase non-receptor type 9 (sprot)

description: A tyrosine-protein phosphatase non-receptor type 9 that is encoded in the genome of human.


Indole-3-acetic acid substituted on nitrogen with a 4-chlorobenzoyl group and at C-5 by a methoxy group.


name: EYA2_HUMAN Eyes absent homolog 2 (sprot)

description: An eyes absent homolog 2 that is encoded in the genome of human.


name: UTY_HUMAN Histone demethylase UTY (sprot)

description: A histone demethylase UTY that is encoded in the genome of human.


4-hydroxyphenylacetic acid

A monocarboxylic acid that is acetic acid in which one of the methyl hydrogens is substituted by a 4-hydroxyphenyl group.


name: ORA1_DANRE Olfactory receptor class A-like protein 1 (sprot)

description: A protein that is a translation product of the ora1 gene in zebrafish.


4-methoxyphenylacetic acid

A monocarboxylic acid that is phenylacetic acid carrying a 4-methoxy substituent. It is used as an intermediate for pharmaceuticals and other organic synthesis. It has been found to inhibit the germination of cress and lettuce seeds.


HYDROXYPHENYL PROPIONIC ACID

A hydroxy monocarboxylic acid consisting of propionic acid having a 4-hydroxyphenyl group at the 3-position.


name: F0KIP0_ACICP Thiol:disulfide interchange protein (trembl)


name: AT1A1_HUMAN Sodium/potassium-transporting ATPase subunit alpha-1 (sprot)

description: A sodium/potassium-transporting ATPase subunit alpha-1 that is encoded in the genome of human.


name: AT1A2_HUMAN Sodium/potassium-transporting ATPase subunit alpha-2 (sprot)

description: A sodium/potassium-transporting ATPase subunit alpha-2 that is encoded in the genome of human.


name: SYFA_ECOLI Phenylalanine--tRNA ligase alpha subunit (sprot)

description: A prokaryotic-type phenylalanine--tRNA ligase alpha subunit that is encoded in the genome of Escherichia coli K-12.


name: ROA1_HUMAN Heterogeneous nuclear ribonucleoprotein A1 (sprot)

description: A heterogeneous nuclear ribonucleoprotein A1 that is encoded in the genome of human.


name: TNNC1_HUMAN Troponin C, slow skeletal and cardiac muscles (sprot)

description: A troponin C, slow skeletal and cardiac muscles that is encoded in the genome of human.


name: HCD2_HUMAN 3-hydroxyacyl-CoA dehydrogenase type-2 (sprot)

description: A 3-hydroxyacyl-CoA dehydrogenase type-2 that is encoded in the genome of human.


name: Diethylaminocoumarin propargyl sulfonamide (4)


name: j']diquinolizin-18-ium inner salt 4'-Propargyl Sulfonamide 2'-Sulfate"


name: SUIS_RAT Sucrase-isomaltase, intestinal (sprot)

description: A sucrase-isomaltase, intestinal that is encoded in the genome of rat.


name: p-Xylidine-bis(dithiocarbamate) sodium salt (II)


name: N-{4-[2-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)ethoxy]phenyl}imidodicarbonimidic diamide hydrochloride (A1-01)


name: N-{4-[3-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)propoxy]phenyl}imidodicarbonimidic diamide hydrochloride (A1-02)


name: N-{4-[3-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)butoxy]phenyl}imidodicarbonimidic diamide hydrochloride (A1-03)


name: N-[4-(Benzyloxy)phenyl]imidodicarbonimidic diamide hydrochloride (B1-01)


name: N-{4-[(3-Chlorobenzyl)oxy]phenyl}imidodicarbonimidic diamide hydrochloride (B1-02)


name: N-{4-[(2-Chlorobenzyl)oxy]phenyl}imidodicarbonimidic diamide hydrochloride (B1-03)


name: N-{4-[(2,4-Dichlorobenzyl)oxy]phenyl}imidodicarbonimidic diamide hydrochloride (B1-04)


name: N-{4-[(4-Bromobenzyl)oxy]phenyl}imidodicarbonimidic diamide hydrochloride (B1-05)


name: N-{4-[(3-Methoxybenzyl)oxy]phenyl}imidodicarbonimidic diamide hydrochloride (B1-06)


name: N-[4-(Biphenyl-4-ylmethoxy)phenyl]imidodicarbonimidic diamide hydrochloride (B1-07)


ALLITRIDIN

An organic trisulfide that is trisulfane in which both of the hydrogens are replaced by allyl groups. A component of the essential oil of garlic and a major component of the traditional Chinese medicine allitridium, it exhibits antifungal, antitumour and antioxidant activity


FAS_CHICK Fatty acid synthase (sprot)

A fatty acid synthase that is encoded in the genome of chicken.


DIALLYLDISULFIDE

An organic disulfide where the organic group specified is allyl. It has been isolated from garlic and other species of the genus Allium.


dimethyl disulfide

An organic disulfide that is methane in which one of the hydrogens has been replaced by a methyldisulfanyl group.


name: FABH_MYCTU Mycobacterial beta-ketoacyl-[acyl-carrier-protein] synthase III (sprot)

description: A beta-ketoacyl-[acyl-carrier-protein] synthase III that is encoded in the genome of Mycobacterium tuberculosis H37Rv.


name: Methyl {4-[7-(2-diethylaminoethoxy)-6-methoxy-quinazolin-4-ylamino]phenyl}carbamate hydrochloride (7b)


name: Methyl {4-[6-(2-diethylaminoethoxy)-7-methoxyquinazolin-4-ylamino]phenyl}carbamate hydrochloride (19b)


name: Ethyl {4-[7-(2-diethylaminoethoxy)-6-methoxy-quinazolin-4-ylamino]phenyl}carbamate hydrochloride (7c)


name: Ethyl {4-[7-(2-diethylaminoethoxy)-6-methoxyquinazolin-4-ylamino]phenyl}carbamate hydrochloride (19c)


name: N-{4-[7-(2-Diethylaminoethoxy)-6-methoxy-quinazolin-4-ylamino]phenyl}-N'-(4-methoxy phenyl)urea hydrochloride (7e)


name: N-{4-[6-(2-Diethylaminoethoxy)-7-methoxy-quinazolin-4-ylamino]phenyl}-N'-(4-methoxy phenyl)urea hydrochloride (19e)


name: N-{4-[7-(2-Diethylaminoethoxy)-6-methoxy-quinazolin-4-ylamino]phenyl}-N'-(2,4-difluoro phenyl)urea hydrochloride (7f)


name: N-{4-[6-(2-Diethylaminoethoxy)-7-methoxy-quinazolin-4-ylamino]phenyl}-N'-(2,4-difluoro phenyl)urea hydrochloride (19f)


gentisein

A member of the class of  xanthones that is 9H-xanthen-9-one substituted by hydroxy groups at positions 1, 3 and 7.


RAS2_YEAST Ras-like protein 2 (sprot)

A protein that is a translation product of the RAS2 gene in yeast.


name: N-2-Phenyl ethyliminobis(methylenephosphonic acid) (8)


S-hexylglutathione

An S-substituted glutathione that is glutathione in which the hydrogen of the thiol has been replaced by a hexyl group (PDB entry: 1PN9).


thymidine

A pyrimidine 2'-deoxyribonucleoside having thymine as the nucleobase.


methylprednisolone acetate

An acetate ester resulting from the formal condensation of the 21-hydroxy function of 6alpha-methylprednisolone compound with acetic acid.


name: rac-{(3S,4R)-4-(3,4-dichloro-phenyl)-1-[1-(1-methyl cyclopropanecarbonyl)-piperidine-4-carbonyl]-pyrrolidin-3-yl}-isobutyl-carbamic acid 4-fluoro-phenyl ester


name: SEPR_MOUSE Prolyl endopeptidase FAP (sprot)

description: A prolyl endopeptidase FAP that is encoded in the genome of mouse.


PPCE_HUMAN Prolyl endopeptidase (sprot)

A prolyl endopeptidase that is encoded in the genome of human.


name: N-[(2S,3R)-2-Methyl-4-oxooxetane-3-yl]carbamic acid 5-phenylpentyl ester


name: NAAA_HUMAN N-acylethanolamine-hydrolyzing acid amidase (sprot)

description: An N-acylethanolamine-hydrolyzing acid amidase that is encoded in the genome of human.


name: SIR3_HUMAN NAD-dependent protein deacetylase sirtuin-3, mitochondrial (sprot)

description: An NAD-dependent protein deacetylase sirtuin-3, mitochondrial that is encoded in the genome of human.


salicylanilide

An amide of salicylic acid and of aniline; it is therefore both a salicylamide and an anilide.


TRIBROMSALAN

A salicylanilide derivative with bromo- substituents at C-3 and C-5 of the salicylate moiety and at C-4 of the anilide moiety.


A nucleobase analogue that is uracil in which the hydrogen at position 5 is replaced by fluorine. It is an antineoplastic agent which acts as an antimetabolite - following conversion to the active deoxynucleotide, it inhibits DNA synthesis (by blocking the conversion of deoxyuridylic acid to thymidylic acid by the cellular enzyme thymidylate synthetase) and so slows tumour growth.


ilomastat

An N-acyl-amino acid obtained by formal condensation of the carboxy group of (2R)-2-[2-(hydroxyamino)-2-oxoethyl]-4-methylpentanoic acid with the amino group of N-methyl-L-tryptophanamide. A cell permeable broad-spectrum matrix metalloproteinase (MMP) inhibitor


eugenol

A phenylpropanoid formally derived from guaiacol with an allyl chain substituted para to the hydroxy group. It is a major component of clove essential oil, and exhibits antibacterial, analgesic and antioxidant properties. It has been widely used in dentistry to treat toothache and pulpitis.


name: LOX3_SOYBN Seed linoleate 9S-lipoxygenase-3 (sprot)


ALPHA-NAPHTHOFLAVONE

An extended flavonoid resulting from the formal fusion of a benzene ring with the h side of flavone. A synthetic compound, it is an inhibitor of aromatase (EC 1.14.14.14).


name: UD11_HUMAN UDP-glucuronosyltransferase 1A1 (sprot)

description: A UDP-glucuronosyltransferase 1A1 that is encoded in the genome of human.


name: UD14_HUMAN UDP-glucuronosyltransferase 1A4 (sprot)

description: A UDP-glucuronosyltransferase 1A4 that is encoded in the genome of human.


quinidine

A cinchona alkaloid consisting of cinchonine with the hydrogen at the 6-position of the quinoline ring substituted by methoxy.


name: UD16_HUMAN UDP-glucuronosyltransferase 1-6 (sprot)

description: A UDP-glucuronosyltransferase 1-6 that is encoded in the genome of human.


name: UD2B7_HUMAN UDP-glucuronosyltransferase 2B7 (sprot)

description: A UDP-glucuronosyltransferase 2B7 that is encoded in the genome of human.


name: UDB10_HUMAN UDP-glucuronosyltransferase 2B10 (sprot)

description: A UDP-glucuronosyltransferase 2B10 that is encoded in the genome of human.


O,O'-DIMETHYLCAFFEIC ACID

A methoxycinnamic acid that is trans-cinnamic acid substituted by methoxy groups at positions 3' and 4' respectively.


TROLOX

A chromanol that is 6-hydroxychromane which is substituted by a carboxy group at position 2 and by methyl groups at positions 2, 5, 7, and 8. A cell-permeable, water-soluble analogue of vitamin E, it is used as a standard for measuring the antioxidant capacity of complex mixtures.


name: NRAM_I82A7 Neuraminidase (Fragment) (sprot)


name: 2-(2-((2S,3R)-2-(tert-Butoxycarbonylamino)-3-methylpentanamido)thiazol-4-yl) acetic acid (5c)


name: (S)-Ethyl 2-(2-(2-(tert-butoxycarbonylamino)-3-methylbutanamido)thiazol-4-yl) acetate (6a)


name: (S)-Ethyl 2-(2-(2-(tert-butoxycarbonylamino)-4-methylpentanamido)thiazol-4-yl) acetate (7a)


name: (S)-Ethyl 2-(2-(2-(tert-butoxycarbonylamino)-4-(methylthio)butanamido)thiazol-4-yl) acetate (8a)


name: (S)-Ethyl 2-(2-(2-(tert-butoxycarbonylamino)-3-phenylpropanamido)thiazol-4-yl) acetate (9a)


name: LDHA_MOUSE L-lactate dehydrogenase A chain (sprot)

description: An L-lactate dehydrogenase A chain that is encoded in the genome of mouse.


name: LDHB_MOUSE L-lactate dehydrogenase B chain (sprot)

description: An L-lactate dehydrogenase B chain that is encoded in the genome of mouse.


name: LDHC_MOUSE L-lactate dehydrogenase C chain (sprot)

description: An L-lactate dehydrogenase C chain that is encoded in the genome of mouse.


name: PDGFB_HUMAN Platelet-derived growth factor subunit B (sprot)

description: A platelet-derived growth factor subunit B that is encoded in the genome of human.


CP2J2_HUMAN Cytochrome P450 2J2 (sprot)

A cytochrome P450 2J2 that is encoded in the genome of human.


name: {(R)-1-[4-carbamoyl-5-(pyridin-2-ylamino)-thiazol-2-yl]-piperidin-3-yl}-carbamic acid tert-butyl ester


afatinib

A quinazoline compound having a 3-chloro-4-fluoroanilino group at the 4-position, a 4-dimethylamino-trans-but-2-enamido group at the 6-position, and an (S)-tetrahydrofuran-3-yloxy group at the 7-position. Used (as its dimaleate salt) for the first-line treatment of patients with metastatic non-small cell lung cancer.


BUTEIN

A chalcone that is (E)-chalcone bearing four additional hydroxy substituents at positions 2', 3, 4 and 4'.


dexamethasone phosphate(2-)

A steroid phosphate oxoanion obtained by deprotonation of the phosphate OH groups of dexamethasone phosphate.


metamizole

A pyrazole that is antiipyrine substituted at C-4 by a methyl(sulfomethyl)amino group, the sodium salt of which, metamizole sodium, was widely used as a powerful analgesic and antipyretic, but withdrawn from many markets from the 1970s due to a risk of causing risk of causing agranulocytosis.


piperine

A N-acylpiperidine that is piperidine substituted by a (1E,3E)-1-(1,3-benzodioxol-5-yl)-5-oxopenta-1,3-dien-5-yl group at the nitrogen atom. It is an alkaloid isolated from the plant Piper nigrum.


name: GSHR_HUMAN Glutathione reductase, mitochondrial (sprot)

description: A glutathione reductase, mitochondrial that is encoded in the genome of human.


name: L-Isoseryl-L-leucine methyl ester hydrochloride (11b)


name: L-Isoseryl-L-phenylalanine benzyl ester hydrochloride (11c)


name: L-Isoseryl-L-leucine benzyl ester hydrochloride (11d)


name: L-Isoseryl-L-leucyl-L-phenylalanine methyl ester hydrochloride (13a)


name: L-Isoseryl-L-phenylalanyl-L-leucine methyl ester hydrochloride (13b)


name: L-Isoseryl-L-leucyl-L-phenylalanine benzyl ester hydrochloride (13c)


name: L-Isoseryl-L-phenylalanyl-L-leucine benzyl ester hydrochloride (13d)


name: trans-(1R(S),6R(S))-6-Hydroxycyclohex-3-enyl hydrogen sulfate (4)


name: trans-(1R(S),8R(S),Z)-8-Hydroxycyclooct-4-enyl hydrogen sulfate (6)


A cyclohexane-1,2-diol with trans-configuration. It is a metabolite of cyclohexene oxide and other such compounds.


name: PDE6A_BOVIN Rod cGMP-specific 3',5'-cyclic phosphodiesterase subunit alpha (sprot)

description: A rod cGMP-specific 3',5'-cyclic phosphodiesterase subunit alpha that is encoded in the genome of cow.


name: P53_HUMAN Cellular tumor antigen p53 (sprot)

description: A cellular tumor antigen p53 that is encoded in the genome of human.


dehydroepiandrosterone

An androstanoid that is androst-5-ene substituted by a beta-hydroxy group at position 3 and an oxo group at position 17. It is a naturally occurring steroid hormone produced by the adrenal glands.


An androstanoid that is androstane substituted by oxo groups at positions 3 and 17.


name: 4-(9-(4-Cyanophenyl)-2,2,7,7-tetramethyl inverted question mark1,8-dioxo inverted question mark1,2,3,4,5,6,7,8-octahydroacridine inverted question mark10(9H)-yl)benzenesulfonamide (9)


name: 4-(9-(4-Hydroxyphenyl)-2,2,7,7-tetramethyl inverted question mark1,8-dioxo inverted question mark1,2,3,4,5,6,7,8-octahydro acridine inverted question mark10(9H)-yl)benzenesulfonamide (10)


name: 4-(9-(3,4-Dimethoxyphenyl)-2,2,7,7-tetramethyl inverted question mark1,8-dioxo inverted question mark1,2,3,4,5,6,7,8-octahydro acridine inverted question mark10(9H)-yl)benzenesulfonamide (11)


name: 4-(9-(2,4-Dichlorophenyl)-2,2,7,7-tetramethyl inverted question mark1,8-dioxo inverted question mark1,2,3,4,5,6,7,8-octahydro acridine inverted question mark10(9H)-yl)benzenesulfonamide (12)


name: [6-Fluoro-2-(3-fluoro-phenyl)-imidazo[1,2-a]pyridin-3-ylamino]-acetic acid methyl ester


ceftizoxime

A parenteral third-generation cephalosporin, bearing a 2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino group at the 7beta-position.


ceftriaxone

A third-generation cephalosporin compound having 2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetylamino and [(2-methyl-5,6-dioxo-1,2,5,6-tetrahydro-1,2,4-triazin-3-yl)sulfanyl]methyl side-groups.


ampicillin

A penicillin in which the substituent at position 6 of the penam ring is a 2-amino-2-phenylacetamido group.


4-GUANIDINO-BENZOIC ACID

Benzoic acid substituted at the para position by a guanidino group.


name: CELA1_PIG Chymotrypsin-like elastase family member 1 (sprot)

description: A chymotrypsin-like elastase family member 1 that is encoded in the genome of pig.


name: ELK1_HUMAN ETS domain-containing protein Elk-1 (sprot)

description: An ETS domain-containing protein Elk-1 that is encoded in the genome of human.


A cyclohexane-1,2-diol with cis-configuration.


A member of the class of hydroxybiphenyls that is biphenyl carrying a hydroxy group at position 4.


guaiacol

A  monomethoxybenzene that consists of phenol with a methoxy substituent at the ortho position.


sulfadiazine

A sulfonamide consisting of pyrimidine with a 4-aminobenzenesulfonamido group at the 2-position.


name: 1-Methyl-3-(4-methyl-7, 8-dihydroxy-2H-chromen-2-one)benzimidazolium chloride (3a)


name: MCL1_MOUSE Induced myeloid leukemia cell differentiation protein Mcl-1 homolog (sprot)

description: An induced myeloid leukemia cell differentiation protein Mcl-1 that is encoded in the genome of mouse.


A member of the class of  phenols that is phenol substituted by methyl groups at positions 3 and 4.


name: FNTB_YEAST Protein farnesyltransferase subunit beta (sprot)

description: A protein farnesyltransferase subunit beta that is encoded in the genome of yeast.


name: SMUF1_HUMAN E3 ubiquitin-protein ligase SMURF1 (sprot)

description: An E3 ubiquitin-protein ligase SMURF1 that is encoded in the genome of human.


HXK4_MOUSE Hexokinase-4 (sprot)

A hexokinase-4 that is encoded in the genome of mouse.


name: MTCA2_MYCTU Carbonic anhydrase 2 (sprot)


4-bromobenzoic acid

A bromobenzoic acid carrying a single bromo subsituent at the 4-position.


ACEDOBEN

A amidobenzoic acid that consists of benzoic acid bearing an acetamido substituent at position 4.


4-NITROBENZOIC ACID

A nitrobenzoic acid having the nitro group at the 4-position.


nipecotic acid

A piperidinemonocarboxylic acid that is piperidine in which one of the hydrogens at position 3 is substituted by a carboxylic acid group.


O-COUMARIC ACID

The trans-isomer of 2-coumaric acid.


name: Carbonic anhydrase isoenzymes inhibitor, 13


name: Carbonic anhydrase isoenzymes inhibitor, 14


name: Carbonic anhydrase isoenzymes inhibitor, 15


name: Carbonic anhydrase isoenzymes inhibitor, 16


A secondary carboxamide resulting from the formal condensation of the carboxy group of 3-cyano-5-(pentafluoro-lambda(6)-sulfanyl)benzoic acid with the amino group of 2,4-dimethyl-5-[6-(pyridin-3-yl)-1H-imidazo[1,2-b]pyrazol-1-yl]aniline. It is a potent TIE-2 inhibitor (Kd = 1.6 nM) which displays in vivo efficacy in some murine glioma models.


name: (S)-2-[(5-Cyclopropyl-6-cyclopropylmethoxy-pyrazine-2-carbonyl)-amino]-3,3-dimethyl-butyric acid methyl ester


name: 2-[(5-Cyclopropyl-6-cyclopropylmethoxy-pyrazine-2-carbonyl)-amino]-2-ethyl-butyric acid methyl ester


name: (S)-3-Cyclopropyl-2-[(5-cyclopropyl-6-cyclopropylmethoxy-pyrazine-2-carbonyl)-amino]-propionic acid methyl ester


name: 2-[(5-Chloro-4-iodo-pyridine-2-carbonyl)-amino]-2-methyl-propionic acid methyl ester


name: PAOX_HUMAN Peroxisomal N(1)-acetyl-spermine/spermidine oxidase (sprot)

description: A peroxisomal N(1)-acetyl-spermine/spermidine oxidase that is encoded in the genome of human.


SMOX_HUMAN Spermine oxidase (sprot)

A spermine oxidase that is encoded in the genome of human.


GLRX1_HUMAN Glutaredoxin-1 (sprot)

A glutaredoxin-1 that is encoded in the genome of human.


cerulenin

An epoxydodecadienamide isolated from several species, including Acremonium, Acrocylindrum and Helicoceras. It inhibits the biosynthesis of several lipids by interfering with enzyme function.


name: (S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpropanamido)-4-methylpentanoic acid hydrochloride (5a)


name: (S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpropanamido)propanoic acid hydrochloride (5c)


name: (S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpropanamido)-2-phenylacetic acid hydrochloride (5e)


name: SPHK1_HUMAN Sphingosine kinase 1 (sprot)

description: A sphingosine kinase 1 that is encoded in the genome of human.


name: SPHK2_MOUSE Sphingosine kinase 2 (sprot)

description: A sphingosine kinase 2 that is encoded in the genome of mouse.


ASAH1_RAT Acid ceramidase (sprot)

An acid ceramidase that is encoded in the genome of rat.


ASAH1_HUMAN Acid ceramidase (sprot)

An acid ceramidase that is encoded in the genome of human.


arbutin

A monosaccharide derivative that is  hydroquinone attached to a beta-D-glucopyranosyl residue at position 4 via a glycosidic linkage.


name: SODC_BOVIN Superoxide dismutase [Cu-Zn] (sprot)


oxytetracycline zwitterion

A zwitterion obtained by transfer of a proton from the 2-hydroxy group to the adjacent tertiary amino group of oxytetracycline; major species at pH 7.3.


lincomycin

A carbohydrate-containing antibiotic produced by the actinomyces Streptomyces lincolnensis.


cefuroxime

A 3-(carbamoyloxymethyl)cephalosporin compound having a 7-(2Z)-2-(furan-2-yl)-2-(methoxyimino)acetamido side chain.


cefoperazone

A semi-synthetic parenteral cephalosporin with a tetrazolyl moiety that confers beta-lactamase resistance.


name: MGST1_HUMAN Microsomal glutathione S-transferase 1 (sprot)

description: A microsomal glutathione S-transferase 1 that is encoded in the genome of human.


name: GPX1_HUMAN Glutathione peroxidase 1 (sprot)

description: A glutathione peroxidase 1 that is encoded in the genome of human.


fezolinetant

A triazolopyrazine that is 5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazine substituted by 3-methyl-1,2,4-thiadiazol-5-yl, 4-fluorobenzoyl and methyl groups at positions 3, 7, and 8R, respectively. It is a prescription medicine used to reduce moderate to severe vasomotor symptoms due to menopause.


name: S5A1_HUMAN 3-oxo-5-alpha-steroid 4-dehydrogenase 1 (sprot)

description: A 3-oxo-5-alpha-steroid 4-dehydrogenase 1 that is encoded in the genome of human.


name: ACKR3_HUMAN Atypical chemokine receptor 3 (sprot)

description: An atypical chemokine receptor 3 that is encoded in the genome of human.


name: US9428491, 1.1: naphtalene-1,5-disulfonic acid


PTHY_HUMAN Parathyroid hormone (sprot)

A parathyroid hormone that is encoded in the genome of human.


name: PTH1R_RAT Parathyroid hormone/parathyroid hormone-related peptide receptor (sprot)

description: A parathyroid hormone/parathyroid hormone-related peptide receptor that is encoded in the genome of rat.


name: ATM_HUMAN Serine-protein kinase ATM (sprot)

description: A serine-protein kinase ATM that is encoded in the genome of human.


name: TRPC5_HUMAN Short transient receptor potential channel 5 (sprot)

description: A short transient receptor potential channel 5 that is encoded in the genome of human.


A  diarylheptanoid that is 1,4,6-heptatrien-3-one substituted by 4-hydroxypheny group at positions 1 and 7 respectively. It has been isolated from the rhizomes of Curcuma domestica and Etlingera elatior.


A  diarylheptanoid that is 4E-6E-dien-3-one substituted by 4-hydroxyphenyl group at positions 1 and 7. It has been isolated from the rhizomes of Curcuma kwangsiensis.


name: R1A_SARS Replicase polyprotein 1a (sprot)


ISOBAVACHALCONE

A member of the class of chalcones that is trans-chalcone substituted by hydroxy groups at positions 4, 2' and 4' and a prenyl group at position 3'.


psoralidin

A member of the class of  coumestans that is  coumestan substituted by hydroxy groups at positions 3 and 9 and a prenyl group at position 2 respectively.


name: carbonic anhydrase (CA) inhibitors, benzenesulphonamide ligand, 3


name: TPIS_HUMAN Triosephosphate isomerase (sprot)

description: A triosephosphate isomerase that is encoded in the genome of human.


name: TPIS_TRYBB Triosephosphate isomerase, glycosomal (sprot)


TOP1_HUMAN DNA topoisomerase 1 (sprot)

A type 1B DNA topoisomerase 1 that is encoded in the genome of human.


CAMPTOTHECIN

A pyranoindolizinoquinoline that is pyrano[3',4':6,7]indolizino[1,2-b]quinoline which is substituted by oxo groups at positions 3 and 14, and by an ethyl group and a hydroxy group at position 4 (the S enantiomer).


formate

A monocarboxylic acid anion that is the conjugate base of formic acid. Induces severe metabolic acidosis and ocular injury in human subjects.


acetate

A monocarboxylic acid anion resulting from the removal of a proton from the carboxy group of acetic acid.


propionate

The conjugate base of propionic acid; a key precursor in lipid biosynthesis.


butyrate

A short-chain fatty acid anion that is the conjugate base of butyric acid, obtained by deprotonation of the carboxy group.


valerate

A short-chain fatty acid anion that is the conjugate base of valeric acid; present in ester form as component of many steroid-based pharmaceuticals.


A dicarboxylic acid dianion obtained by the deprotonation of the carboxy groups of malonic acid.


A C4-dicarboxylate that is the Z-isomer of but-2-enedioate(2-)


A C4-dicarboxylate resulting from deprotonation of both carboxy groups of malic acid.


lactate

A hydroxy monocarboxylic acid anion that is the conjugate base of lactic acid, arising from deprotonation of the carboxy group.


benzoate

The simplest member of the class of  benzoates that is the conjugate base of benzoic acid, comprising a benzoic acid core with a proton missing to give a charge of -1.


name: Cathepsin S inhibitor alpha-ketoamide, 6a


name: Cathepsin S inhibitor alpha-ketoamide, 6b


name: Cathepsin S inhibitor alpha-ketoamide, 6e


name: Cathepsin S inhibitor alpha-ketoamide, 6n


name: Cathepsin S inhibitor alpha-ketoamide, 6p


name: Cathepsin S inhibitor alpha-ketoamide, 6r


name: Cathepsin S inhibitor alpha-ketoamide, 6w


carvacrol

A phenol that is a natural monoterpene derivative of cymene. An inhibitor of  bacterial growth, it is used as a food additive. Potent activator of the human ion channels transient receptor potential V3 (TRPV3) and A1 (TRPA1).


thymol

A phenol that is a natural monoterpene derivative of cymene.


MENTHOL

Any secondary alcohol that is one of the eight possible diastereoisomers of 5-methyl-2-(propan-2-yl)cyclohexan-1-ol.


vanillin

A member of the class of benzaldehydes carrying methoxy and hydroxy substituents at positions 3 and 4 respectively.


P-CYMENE

A monoterpene that is toluene substituted by an isopropyl group at position 4.


ORTHOCRESOL

A cresol that is phenol substituted by a methyl group at position 2. It is a minor urinary metabolite of toluene.


name: TRPM8_RAT Transient receptor potential cation channel subfamily M member 8 (sprot)

description: A transient receptor potential cation channel TRPM8 that is encoded in the genome of rat.


name: PIM1_MOUSE Serine/threonine-protein kinase pim-1 (sprot)

description: A proto-oncogene serine/threonine-protein kinase Pim-1 that is encoded in the genome of mouse.


infigratinib

A member of the class of phenylureas that is urea in which a hydrogen attached to one of the nitrogens is replaced by a 2,6-dichloro-3,5-dimethoxyphenyl group, while the hydrogens attached to the other nitrogen are replaced by a methyl group and a 6-{[4-(4-ethylpiperazin-1-yl)phenyl]amino}pyrimidin-4-yl group. It is a potent and selective fibroblast growth factor receptor inhibitor.


name: CXL10_HUMAN C-X-C motif chemokine 10 (sprot)

description: A C-X-C motif chemokine 10 that is encoded in the genome of human.


name: (RS)-(4-pyrrolidin-3-yl-phenyl)-carbamic acid 4,4-difluoro-cyclohexyl ester


name: (RS)-(4-pyrrolidin-3-yl-phenyl)-carbamic acid 2-(4-chloro-phenyl)-ethyl ester


name: BMR1B_HUMAN Bone morphogenetic protein receptor type-1B (sprot)

description: A BMP receptor type-1B that is encoded in the genome of human.


selenate

A divalent inorganic anion obtained by removal of both protons from selenic acid.


perchlorate

A monovalent inorganic anion obtained by deprotonation of perchloric acid.


name: SCNAA_HUMAN Sodium channel protein type 10 subunit alpha (sprot)

description: A sodium channel protein type 10 subunit alpha that is encoded in the genome of human.


name: LPAR5_HUMAN Lysophosphatidic acid receptor 5 (sprot)

description: A lysophosphatidic acid receptor 5 that is encoded in the genome of human.


CFAB_HUMAN Complement factor B (sprot)

A complement factor B that is encoded in the genome of human.


name: (+-)-11-(2-Fluoroethyl)-8-methoxy-6,11-dihydro-5-thia-11-aza-benzo[a] fluorene-6-carboxylic acid diethyl amide


cinacalcet

A secondary amino compound that is (1R)-1-(naphthalen-1-yl)ethanamine in which one of the hydrogens attached to the nitrogen is substituted by a 3-[3-(trifluoromethyl)phenyl]propyl group.


name: TS1R1_HUMAN Taste receptor type 1 member 1 (sprot)

description: A taste receptor type 1 member 1 that is encoded in the genome of human.


name: D-Leucine, N-(1-oxo-3-phenyl-2-propenyl)-, methyl ester, (E)-


name: TS1R3_HUMAN Taste receptor type 1 member 3 (sprot)

description: A taste receptor type 1 member 3 that is encoded in the genome of human.


name: US9670136, 58 N1-((trans)-2-(6-((3-methylbenzyl)amino)pyridin-3-yl)cyclopropyl) cyclohexane-1,4-diamine


name: US9670136, 55 N1-((trans)-2-(4-((3-(piperazin-1-yl)benzyl)oxy)phenyl)cyclopropyl) cyclohexane-1,4-diamine


name: US9670136, 59 3-((5-((trans)-2-((4-aminocyclohexyl)amino)cyclopropyl)pyridin-2-yl) amino)benzonitrile


name: 4-[Cyclopropyl-(4-oxazol-5-yl-benzoyl)-amino]-2-methyl-piperidine-1-carboxylic acid tert-butyl ester


name: 4-{Cyclopropyl-[4-(2-methyl-oxazol-4-yl)-benzoyl]-amino}-piperidine-1-carboxylic acid tert-butyl ester


name: 4-[Cyclopropyl-(3-methoxy-4-oxazol-5-yl-benzoyl)-amino]-piperidine-1-carboxylic acid tert-butyl ester


name: 4-{Cyclopropyl-[4-(1-methyl-1H-[1,2,4]triazol-3-yl)-benzoyl]-amino}-piperidine-1-carboxylic acid tert-butyl ester


name: 4-{Cyclopropyl-[4-(5-methanesulfonyl-pyridin-2-yl)-benzoyl]-amino}-piperidine-1-carboxylic acid tert-butyl ester


name: 4-[Cyclopropyl-(4-[1,2,4]oxadiazol-3-yl-benzoyl)-amino]-piperidine-1-carboxylic acid tert-butyl ester


name: 4-{[4-(3-Cyano-pyridin-4-yl)-benzoyl]-cyclopropyl-amino}-piperidine-1-carboxylic acid tert-butyl ester


name: 4-[Cyclopropyl-(3,5-difluoro-4-oxazol-5-yl-benzoyl)-amino]-piperidine-1-carboxylic acid tert-butyl ester


name: 4-[Cyclopropyl-(4'-methanesulfonylmethyl-biphenyl-4-carbonyl)-amino]-piperidine-1-carboxylic acid tert-butyl ester


name: 4-[Cyclopropyl-(4-oxazol-5-yl-benzoyl)-amino]-3-methoxy-piperidine-1-carboxylic acid tert-butyl ester


name: 4-[Cyclopropyl[4-(5-isoxazolyl)benzoyl]amino]-1-piperidinecarboxylic acid 1,1-dimethylethyl ester


name: 4-[Cyclopropyl[4-(2-furanyl)benzoyl]amino]-1-piperidinecarboxylic acid 1,1-dimethylethyl ester


name: 4-[Cyclopropyl[4-(5-pyrimidinyl)benzoyl]amino]-1-piperidinecarboxylic acid 1,1-dimethylethyl ester


name: 4-[(4'-Carbamoyl-biphenyl-4-carbonyl)-cyclopropyl-amino]-piperidine-1-carboxylic acid isopropyl ester


name: 4-[Cyclopropyl-(4-oxazol-5-yl-benzoyl)-amino]-3-methyl-piperidine-1-carboxylic acid tert-butyl ester


name: 4-{Cyclopropyl-[4-(4-methyl-oxazol-5-yl)-benzoyl]-amino}-piperidine-1-carboxylic acid tert-butyl ester


name: 4-[Cyclopropyl-(4-oxazol-5-yl-benzoyl)-amino]-piperidine-1-carboxylic acid tetrahydro-pyran-4-ylmethyl ester


name: 4-{Cyclopropyl-[4-(2-methyl-2H-[1,2,4]triazol-3-yl)-benzoyl]-amino}-piperidine-1-carboxylic acid tert-butyl ester


name: 4-{Cyclopropyl-[4-(5-methylcarbamoyl-pyridin-2-yl)-benzoyl]-amino}-piperidine-1-carboxylic acid tert-butyl ester


name: 4-{[4-(3-Cyano-pyridin-4-yl)-3-fluoro-benzoyl]-cyclopropyl-amino}-piperidine-1-carboxylic acid tert-butyl ester


name: 4-{Cyclopropyl-[4-(3-methyl-3H-imidazol-4-yl)-benzoyl]-amino}-piperidine-1-carboxylic acid tert-butyl ester


name: 4-[Cyclopropyl[4-(2-thienyl)benzoyl]amino]-1-piperidinecarboxylic acid 1,1-dimethylethyl ester


name: 4-[Cyclopropyl[4-(1,3,4-oxadiazol-2-yl)benzoyl]amino]-1-piperidinecarboxylic acid 1,1-dimethylethyl ester


name: 4-[Cyclopropyl[4-(4-pyridinyl)benzoyl]amino]-1-piperidinecarboxylic acid 1,1-dimethylethyl ester


name: 4-[(4'-Carbamoyl-biphenyl-4-carbonyl)-cyclopropyl-amino]-piperidine-1-carboxylic acid tert-butyl ester


name: 4-[Cyclopropyl-(4-oxazol-5-yl-benzoyl)-amino]-piperidine-1-carboxylic acid 2,2,2-trifluoro-1,1-dimethyl-ethyl ester


name: 4-[Cyclopropyl-(4-oxazol-5-yl-benzoyl)-amino]-piperidine-1-carboxylic acid isopropenyl ester


name: 4-[Cyclopropyl-(3-nitro-4-oxazol-5-yl-benzoyl)-amino]-piperidine-1-carboxylic acid tert-butyl ester


name: 4-[Cyclopropyl-(4-oxazol-5-yl-benzoyl)-amino]-piperidine-1-carboxylic acid tetrahydro-pyran-4-yl ester


name: 4-[Cyclopropyl-(4-oxazol-5-yl-benzoyl)-amino]-piperidine-1-carboxylic acid 2-hydroxy-2-methyl-propyl ester


name: 4-[Cyclopropyl-(4-pyridazin-4-yl-benzoyl)-amino]-piperidine-1-carboxylic acid tert-butyl ester


name: 4-{Cyclopropyl-[4-(5-methyl-pyrimidin-4-yl)-benzoyl]-amino}-piperidine-1-carboxylic acid tert-butyl ester


name: 4-{[4-(3-Cyano-pyridin-4-yl)-benzoyl]-cyclopropyl-amino}-piperidine-1-carboxylic acid isopropyl ester


name: 4-[Cyclopropyl-(2-fluoro-4-oxazol-5-yl-benzoyl)-amino]-piperidine-1-carboxylic acid tert-butyl ester


name: 4-{Cyclopropyl-[4-(2-methyl-oxazol-5-yl)-benzoyl]-amino}-piperidine-1-carboxylic acid tert-butyl ester


name: 4-[Cyclopropyl[4-(2-thiazolyl)benzoyl]amino]-1-piperidinecarboxylic acid 1,1-dimethylethyl ester


name: 4-[Cyclopropyl[4-(1H-1,2,4-triazol-1-yl)benzoyl]amino]-1-piperidinecarboxylic acid 1,1-dimethylethyl ester


name: 4-[Cyclopropyl[4-(3-pyridinyl)benzoyl]amino]-1-piperidinecarboxylic acid 1,1-dimethylethyl ester


name: 4-{Cyclopropyl-[4-(4-iodo-oxazol-5-yl)-benzoyl]-amino}-piperidine-1-carboxylic acid tert-butyl ester


name: 4-[(3-Amino-4-oxazol-5-yl-benzoyl)-cyclopropyl-amino]-piperidine-1-carboxylic acid tert-butyl ester


name: 4-{Cyclopropyl-[4-(1H-pyrazol-4-yl)-benzoyl]-amino}-piperidine-1-carboxylic acid tert-butyl ester


name: 4-{Cyclopropyl-[4-(6-methyl-pyridazin-3-yl)-benzoyl]-amino}-piperidine-1-carboxylic acid tert-butyl ester


name: 4-[Cyclopropyl-(4-oxazol-5-yl-benzoyl)-amino]-piperidine-1-carboxylic acid 1-methyl-cyclopropyl ester


name: 4-[Cyclopropyl-(3-methyl-4-oxazol-5-yl-benzoyl)-amino]-piperidine-1-carboxylic acid tert-butyl ester


name: 4-{[4-(3-Cyano-pyridin-4-yl)-benzoyl]-cyclopropyl-amino}-piperidine-1-carboxylic acid 1-methyl-cyclopropyl ester


name: 4-[Cyclopropyl-(2,6-difluoro-4-oxazol-5-yl-benzoyl)-amino]-piperidine-1-carboxylic acid tert-butyl ester


name: 4-[Cyclopropyl-(4-oxazol-4-yl-benzoyl)-amino]-piperidine-1-carboxylic acid tert-butyl ester


name: 4-[Cyclopropyl[4-(1H-pyrrol-1-yl)benzoyl]amino]-1-piperidinecarboxylic acid 1,1-dimethylethyl ester


name: 4-({(4-Cyclopropylisoquinolin-3-yl) [4-(trifluoromethoxy)benzyl]amino}sulfonyl)-2-(methoxymethyl) benzoic acid


name: {tert-Butyl-[6-cyclopropylmethoxy-5-(3,3-difluoro-azetidin-1-yl)-pyrazine-2-carbonyl]-amino}-acetic acid ethyl ester


name: (S)-1-(5-Cyclopropyl-6-cyclopropylmethoxy-pyrazine-2-carbonyl)-pyrrolidine-2-carboxylic acid methyl ester


name: Acetic acid 1-(5-cyclopropyl-6-cyclopropylmethoxy-pyrazine-2-carbonyl)-3-methyl-pyrrolidin-3-yl ester


name: Acetic acid (S)-1-[6-cyclopropylmethoxy-5-(3,3-difluoro-azetidin-1-yl)-pyrazine-2-carbonyl]-pyrrolidin-3-yl ester


name: Acetic acid 1-[6-cyclopropylmethoxy-5-(3,3-difluoro-azetidin-1-yl)-pyrazine-2-carbonyl]-3-methyl-pyrrolidin-3-yl ester


name: SHIP2_HUMAN Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2 (sprot)

description: A phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2 that is encoded in the genome of human.


name: PTN3_HUMAN Tyrosine-protein phosphatase non-receptor type 3 (sprot)

description: A tyrosine-protein phosphatase non-receptor type 3 that is encoded in the genome of human.


name: SSU72_HUMAN RNA polymerase II subunit A C-terminal domain phosphatase SSU72 (sprot)

description: An RNA polymerase II subunit A C-terminal domain phosphatase SSU72 that is encoded in the genome of human.


name: DUS23_HUMAN Dual specificity protein phosphatase 23 (sprot)

description: A dual specificity protein phosphatase 23 that is encoded in the genome of human.


name: PTPRG_HUMAN Receptor-type tyrosine-protein phosphatase gamma (sprot)

description: A receptor-type tyrosine-protein phosphatase gamma that is encoded in the genome of human.


name: DUS10_HUMAN Dual specificity protein phosphatase 10 (sprot)

description: A dual specificity protein phosphatase 10 that is encoded in the genome of human.


name: PTPRM_HUMAN Receptor-type tyrosine-protein phosphatase mu (sprot)

description: A receptor-type tyrosine-protein phosphatase mu that is encoded in the genome of human.


name: PTN14_HUMAN Tyrosine-protein phosphatase non-receptor type 14 (sprot)

description: A tyrosine-protein phosphatase non-receptor type 14 that is encoded in the genome of human.


name: PTN21_HUMAN Tyrosine-protein phosphatase non-receptor type 21 (sprot)

description: A tyrosine-protein phosphatase non-receptor type 21 that is encoded in the genome of human.


name: UBCP1_HUMAN Ubiquitin-like domain-containing CTD phosphatase 1 (sprot)

description: A ubiquitin-like domain-containing CTD phosphatase 1 that is encoded in the genome of human.


EPM2A_HUMAN Laforin (sprot)

A laforin (human), isoforms 1, 2, 4, 5, 6, 7, and 8.


name: CC14A_HUMAN Dual specificity protein phosphatase CDC14A (sprot)

description: A dual specificity protein phosphatase CDC14A that is encoded in the genome of human.


name: PTPA_MOUSE Serine/threonine-protein phosphatase 2A activator (sprot)

description: A serine/threonine-protein phosphatase 2A regulatory subunit B' that is encoded in the genome of mouse.


name: {3-[(5-Cyclopropyl-6-cyclopropylmethoxy-pyridine-2-carbonyl)-amino]-oxetan-3-yl}-acetic acid ethyl ester


name: 3-{[6-Cyclopropylmethoxy-5-(3,3-difluoro-azetidin-1-yl)-pyridine-2-carbonyl]-amino}-3-phenyl-propionic acid ethyl ester


name: 3-{[6-Cyclopropylmethoxy-5-(3,3-difluoro-azetidin-1-yl)-pyridine-2-carbonyl]-amino}-3-methyl-butyric acid ethyl ester


name: 3-[(5-Cyclopropyl-6-cyclopropylmethoxy-pyridine-2-carbonyl)-amino]-5-methyl-hexanoic acid ethyl ester


perazine

A phenothiazine derivative in which 10H-phenothiazinecarries a 3-(4-methylpiperazin-1-yl)propyl substituent at the N-10 position.


pacatal

A phenothiazine derivative in which 10H-phenothiazine has an N-methylpiperidin-4-ylmethyl substituent at the N-10 position.


name: RFA1_HUMAN Replication protein A 70 kDa DNA-binding subunit (sprot)

description: A replication protein A 70 kDa DNA-binding subunit that is encoded in the genome of human.


name: VCAM1_HUMAN Vascular cell adhesion protein 1 (sprot)

description: A vascular cell adhesion protein 1 that is encoded in the genome of human.


thalidomide

A dicarboximide that is isoindole-1,3(2H)-dione in which the hydrogen attached to the nitrogen is substituted by a 2,6-dioxopiperidin-3-yl group.


name: DDB1_HUMAN DNA damage-binding protein 1 (sprot)

description: A DNA damage-binding protein 1 that is encoded in the genome of human.


lenalidomide

A dicarboximide that consists of 1-oxoisoindoline bearing an amino substituent at position 4 and a 2,6-dioxopiperidin-3-yl group at position 2. Inhibits the secretion of TNF-alpha.


pomalidomide

An aromatic amine that is thalidomide substituted at position 4 on the isoindole ring system by an amino group. Used for the treatment of multiple myeloma in patients who failed to respond to previous therapies.


CRBN_HUMAN Protein cereblon (sprot)

A protein cereblon that is encoded in the genome of human.


(S)-thalidomide

A 2-(2,6-dioxopiperidin-3-yl)-1H-isoindole-1,3(2H)-dione that has S-configuration at the chiral centre.


name: CELA1_BOVIN Chymotrypsin-like elastase family member 1 (sprot)


name: IF4A3_HUMAN Eukaryotic initiation factor 4A-III (sprot)

description: A eukaryotic initiation factor 4A-III that is encoded in the genome of human.


name: PSA6_HUMAN Proteasome subunit alpha type-6 (sprot)

description: A proteasome subunit alpha type-6 that is encoded in the genome of human.


ACT_YEAST Actin (sprot)

An actin, cytoplasmic 2 that is encoded in the genome of yeast.


LATRUNCULIN A

A bicyclic macrolide natural product consisting of a 16-membered bicyclic lactone attached to the rare 2-thiazolidinone moiety. It is obtained from the Red Sea sponge Latrunculia magnifica and from the Fiji Islands sponge Cacospongia mycofijiensis. Latrunculin A inhibits actin polymerisation, microfilament organsation and microfilament-mediated processes.


chondramide C

A chondramide formally obtained from N-[(2S,4E,6R,7R)-7-hydroxy-2,4,6-trimethyloct-4-enoyl]-L-alanyl-Nalpha-methyl-D-tryptophanyl-beta-R-beta-tyrosine by intramolecular condensation of the alcoholic hydroxy group with the carboxy group of the beta-tyrosine residue. It is produced by strains of the myxobacterium, Chondromyces crocatus.


name: UCHL1_HUMAN Ubiquitin carboxyl-terminal hydrolase isozyme L1 (sprot)

description: A ubiquitin carboxyl-terminal hydrolase isozyme L1 that is encoded in the genome of human.


name: UCHL5_HUMAN Ubiquitin carboxyl-terminal hydrolase isozyme L5 (sprot)

description: A ubiquitin carboxyl-terminal hydrolase isozyme L5 that is encoded in the genome of human.


name: UBP15_HUMAN Ubiquitin carboxyl-terminal hydrolase 15 (sprot)

description: A ubiquitin carboxyl-terminal hydrolase 15 that is encoded in the genome of human.


name: BRCA2_HUMAN Breast cancer type 2 susceptibility protein (sprot)

description: A breast cancer type 2 susceptibility protein that is encoded in the genome of human.


name: 4-Ureidophenyl sulfamate ring derivative 3ae


name: 4-Ureidophenyl sulfamate ring derivative 3af


name: BRD1_HUMAN Bromodomain-containing protein 1 (sprot)

description: A bromodomain-containing protein 1 that is encoded in the genome of human.


BRPF1_HUMAN Peregrin (sprot)

A peregrin that is encoded in the genome of human.


name: BRPF3_HUMAN Bromodomain and PHD finger-containing protein 3 (sprot)

description: A bromodomain and PHD finger-containing protein 3 that is encoded in the genome of human.


name: [4'-(5-amino-1H-[1,2,4]triazol-3-ylamino)-2'-chloro-6'-trifluoromethyl-biphenyl-4-yl]-carbamic acid propyl ester


name: [4'-(5-Amino-1H-[1,2,4]triazol-3-ylamino)-2',6'-dichloro-biphenyl-4-yloxy]-acetic acid tert-butyl ester


name: (S)-methyl 5-cyclopropyl-4-((1-(1-(3, 5-dichlorophenyl) ethyl) piperidin-4-yl) methoxy)-2-fluorobenzoate


IL1B_HUMAN Interleukin-1 beta (sprot)

An interleukin-1 beta that is encoded in the genome of human.


name: CSF2_HUMAN Granulocyte-macrophage colony-stimulating factor (sprot)

description: A granulocyte-macrophage colony-stimulating factor that is encoded in the genome of human.


name: MDC1_HUMAN Mediator of DNA damage checkpoint protein 1 (sprot)

description: A mediator of DNA damage checkpoint protein 1 that is encoded in the genome of human.


name: CCL3_HUMAN C-C motif chemokine 3 (sprot)

description: A C-C motif chemokine 3 that is encoded in the genome of human.


name: G3PC_LEIME Glyceraldehyde-3-phosphate dehydrogenase, cytosolic (sprot)


tenofovir disoproxil

An organic phosphonate that is the disoproxil ester of tenofovir. A prodrug for tenofovir, an HIV-1 reverse transcriptase inhibitor, tenofovir disoproxil is used as the fumaric acid salt in combination therapy for the treatment of HIV infection.


zidovudine

A pyrimidine 2',3'-dideoxyribonucleoside compound having a 3'-azido substituent and thymine as the nucleobase.


KLK14_HUMAN Kallikrein-14 (sprot)

A kallikrein-14 that is encoded in the genome of human.


ANDR_MOUSE Androgen receptor (sprot)

An androgen receptor that is encoded in the genome of mouse.


SORT_HUMAN Sortilin (sprot)

A sortilin that is encoded in the genome of human.


iptacopan

A member of the class of indoles that is 1H-indole substituted by [(2S,4S)-2-(4-carboxyphenyl)-4-ethoxypiperidin-1-yl]methyl, methoxy, and methyl groups at positions 4, 5, and 6, respectively. It is a potent inhibitor of complement factor B (IC50 = 10nM) with potential immunomodulatory activity.


name: BUB1_HUMAN Mitotic checkpoint serine/threonine-protein kinase BUB1 (sprot)

description: A mitotic checkpoint serine/threonine-protein kinase BUB1 that is encoded in the genome of human.


name: US9687479, 59 2-[3-(5-[(5-chlorothiophen-2-yl)methyl]amino-1H-pyrazol-3-yl)-2-oxo-1,2-dihydropyridin-1-yl]acetic acid


name: US9687479, 260 ethyl 2-[3-(5-[(5-chlorothiophen-2-yl)methyl]amino-1H-pyrazol-3-yl)-2-oxo-1,2-dihydropyridin-1-yl]acetate


name: CAC1G_HUMAN Voltage-dependent T-type calcium channel subunit alpha-1G (sprot)

description: A voltage-dependent T-type calcium channel subunit alpha-1G that is encoded in the genome of human.


name: FFAR1_RAT Free fatty acid receptor 1 (sprot)

description: A free fatty acid receptor 1 that is encoded in the genome of rat.


name: KCNN2_RAT Small conductance calcium-activated potassium channel protein 2 (sprot)

description: A small conductance calcium-activated potassium channel protein 2 that is encoded in the genome of rat.


name: KCNN3_HUMAN Small conductance calcium-activated potassium channel protein 3 (sprot)

description: A small conductance calcium-activated potassium channel protein 3 that is encoded in the genome of human.


name: SCN3A_HUMAN Sodium channel protein type 3 subunit alpha (sprot)

description: A sodium channel protein type 3 subunit alpha that is encoded in the genome of human.


name: SCN4A_HUMAN Sodium channel protein type 4 subunit alpha (sprot)

description: A sodium channel protein type 4 subunit alpha that is encoded in the genome of human.


name: KCNB1_HUMAN Potassium voltage-gated channel subfamily B member 1 (sprot)

description: A voltage-gated potassium channel KCNB1 that is encoded in the genome of human.


EDN1_HUMAN Endothelin-1 (sprot)

An endothelin-1 that is encoded in the genome of human.


name: US9688661, 1-(5-Chloro-2-methylphenyl)-4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrrole-2-carbonitrile (compd 63)


name: US9688661, 1-(5-Chloro-2-ethylphenyl)-4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrrole-2-carbonitrile (compd 68)


name: US9688661, 3-(5-Chloro-2-methylphenyl)-N-methyl-5-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrrole-2-carboxamide (compd 129)


name: US9688661, 3-(5-Chloro-2-ethylphenyl)-N-methyl-5-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrrole-2-carboxamide (compd 130)


name: US9688661, 5-(6-Aminopyrimidin-4-yl)-2-(5-chloro-2-methylphenyl)-1H-pyrrole-3-carboxamide (compd 189)


name: US9688661, 2-(5-Chloro-2-ethylphenyl)-5-[6-(methylamino)pyrimidin-4-yl]-1H-pyrrole-3-carboxamide (compd 198)


name: US9688661, 2-(5-Chloro-2-methylphenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1H-pyrrole-3-carboxamide (compd 192)


name: US9688661, 5-(6-Aminopyrimidin-4-yl)-2-(5-chloro-2-ethylphenyl)-1H-pyrrole-3-carboxamide (compd 197)


name: US9688661, 2-(5-Chloro-2-ethylphenyl)-5-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrrole-3-carboxamide (compd 199)


name: US9688661, 5-(6-Aminopyrimidin-4-yl)-2-[2-chloro-5-(trifluoromethyl)phenyl]-1H-pyrrole-3-carboxamide (compd 204)


name: US9688661, 2-[2-Chloro-5-(trifluoromethyl)phenyl]-5-[6-(methylamino)pyrimidin-4-yl]-1H-pyrrole-3-carboxamide (compd 205)


name: US9688661, 5-(6-Aminopyrimidin-4-yl)-2-[2-methyl-5-(trifluoromethyl)phenyl]-1H-pyrrole-3-carboxamide (compd 211)


name: US9688661, 5-[6-(Methylamino)pyrimidin-4-yl]-2-[2-methyl-5-(trifluoromethyl)phenyl]-1H-pyrrole-3-carboxamide (compd 212)


name: US9688661, 5-(6-Aminopyrimidin-4-yl)-2-[2-ethyl-5-(trifluoromethyl)phenyl]-1H-pyrrole-3-carboxamide (compd 218)


name: US9688661, 2-[2-Ethyl-5-(trifluoromethyl)phenyl]-5-[6-(methylamino)pyrimidin-4-yl]-1H-pyrrole-3-carboxamide (compd 219)


name: US9688661, 1-(5-chloro-2-methylphenyl)-4-(1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1H-pyrrole-2-carboxamide (compd 232)


name: US9688661, 4-(6-Aminopyrimidin-4-yl)-1-(5-chloro-2-ethylphenyl)-1H-pyrrole-2-carboxamide (compd 235)


name: US9688661, 1-(5-Chloro-2-ethylphenyl)-4-[6-(methylamino)pyrimidin-4-yl]-1H-pyrrole-2-carboxamide (compd 236)


name: US9688661, 1-(5-Chloro-2-ethylphenyl)-4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrrole-2-carboxamide (compd 237)


name: US9688661, 1-[2-Chloro-5-(trifluoromethyl)phenyl]-4-(9H-purin-6-yl)-1H-pyrrole-2-carboxamide (compd 245)


name: US9688661, 4-(6-Aminopyrimidin-4-yl)-1-[2-ethyl-5-(trifluoromethyl)phenyl]-1H-pyrrole-2-carboxamide (compd 256)


name: US9688661, 5-(6-Aminopyrimidin-4-yl)-2-(5-chloro-2-ethylphenyl)-N-methyl-1H-pyrrole-3-carboxamide (compd 301)


name: US9688661, 2-(5-Chloro-2-ethylphenyl)-N-methyl-5-[6-(methylamino)pyrimidin-4-yl]-1H-pyrrole-3-carboxamide (compd 302)


name: US9688661, 2-(5-Chloro-2-ethylphenyl)-N-methyl-5-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrrole-3-carboxamide (compd 303)


name: US9688661, 5-(6-Aminopyrimidin-4-yl)-2-[2-ethyl-5-(trifluoromethyl)phenyl]-N-methyl-1H-pyrrole-3-carboxamide (compd 321)


name: SPHK2_HUMAN Sphingosine kinase 2 (sprot)

description: A sphingosine kinase 2 that is encoded in the genome of human.


name: PAR4_HUMAN Proteinase-activated receptor 4 (sprot)

description: A proteinase-activated receptor 4 that is encoded in the genome of human.


A member of the class of hydroxybiphenyls that is biphenyl with hydroxy groups at positions 4 and 4'.


GSK591 (EPZ015866) is a potent and selective inhibitor of protein methyltransferase 5 (PRMT5).


name: US9676701, 2 (trans)-2-(terphenyl-4-yl)cyclopropanamine hydrochloride


name: US9676701, 3 4'-((trans)-2-aminocyclopropyl)biphenyl-4-ol hydrochloride


name: US9676701, 5 (trans)-2-(6-(3-(trifluoromethyl)phenyl)pyridin-3-yl)cyclopropanamine dihydrochloride


name: US9676701, 6 (Trans)-2-(6-(3,5-dichlorophenyl)pyridin-3-yl)cyclopropanamine hydrochloride


name: US9676701, 7 (trans)-2-(6-(4-chlorophenyl)pyridin-3-yl)cyclopropanamine hydrochloride


name: US9676701, 8 (trans)-2-(6-(3-chlorophenyl)pyridin-3-yl)cyclopropanamine hydrochloride