name: 6-(3-Ethoxy-pyridin-2-ylamino)-pyridine-2-carboxylic acid methyl ester


name: Phosphoric acid mono-[1-butyl-3-(2-dimethylamino-ethyl)-1H-indol-4-yl] ester


betrixaban

A secondary carboxamide obtained by formal condensation of the carboxy group of 4-(N,N-dimethylcarbamimidoyl)benzoic acid with the amino group of 2-amino-N-(5-chloropyridin-2-yl)-5-methoxybenzamide. A synthetic anticoagulant compound that targets activated factor Xa in the coagulation cascade.


name: NOTC2_HUMAN Neurogenic locus notch homolog protein 2 (sprot)

description: A neurogenic locus notch homolog protein 2 that is encoded in the genome of human.


name: NOTC4_HUMAN Neurogenic locus notch homolog protein 4 (sprot)

description: A neurogenic locus notch homolog protein 4 that is encoded in the genome of human.


carmustine

A member of the class of N-nitrosoureas that is 1,3-bis(2-chloroethyl)urea in which one of the nitrogens is substituted by a nitroso group.


name: SETD2_HUMAN Histone-lysine N-methyltransferase SETD2 (sprot)

description: A histone-lysine N-methyltransferase SETD2 that is encoded in the genome of human.


A secondary carboxamide resulting from the formal condensation of the carboxy group of 5-cyano-2'-{4-[2-(3-methyl-1H-indol-1-yl)ethyl]piperazin-1-yl}[biphenyl]-3-carboxylic acid with the amino group of 3-(pyrrolidin-1-yl)propan-1-amine. It is a potent and selective inhibitor of SMYD2 and inhibits the ability of SMYD2 to methylate p53. It serves as a valuable chemical probe to aid in the dissection of SMYD2 function in cancer and other biological processes.


A benzoxazine that is 2H-1,4-benzoxazin-3(4H)-one substituted by a hydroxy group at position 5 and a 2-{[2-(cyclohexyl{N-[2-(3,4-dichlorophenyl)ethyl]-beta-alanyl}amino)ethyl]amino}ethyl group at position 8. It is a potent and selective inhibitor of SMYD2.


NANAFROCIN

A pyranonaphthoquinone antibiotic from strain OS-3966 of Streptomyces rosa var. notoensis.


name: DNM3B_HUMAN DNA (cytosine-5)-methyltransferase 3B (sprot)

description: A DNA (cytosine-5)-methyltransferase 3B that is encoded in the genome of human.


name: 4-Methyl-5-[2-oxo-1,2-dihydro-indol-(3Z)-ylidenemethyl]-1H-pyrrole-2-carboxylic acid ethyl ester


name: AK1A1_PIG Aldo-keto reductase family 1 member A1 (sprot)

description: An aldo-keto reductase family 1 member A1 that is encoded in the genome of pig.


EST2_HUMAN Cocaine esterase (sprot)

A cocaine esterase that is encoded in the genome of human.


name: 4-Benzylamino-5-ethyl-pyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid ethyl ester


LOBELINE

An optically active piperidine alkaloid having a 2-oxo-2-phenylethyl substituent at the 2-position and a 2-hydroxy-2-phenylethyl group at the 6-position.


name: 4-Pyridin-2-ylethynyl-3,6-dihydro-2H-pyridine-1-carboxylic acid phenyl ester


name: 4-Pyridin-2-ylethynyl-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester


name: 4-Pyridin-2-ylethynyl-3,6-dihydro-2H-pyridine-1-carboxylic acid benzyl ester


name: TSSK3_HUMAN Testis-specific serine/threonine-protein kinase 3 (sprot)

description: A testis-specific serine/threonine-protein kinase 3 that is encoded in the genome of human.


name: Acetic acid 2-({6-[2-(3,4-dichloro-phenoxy)-acetylamino]-4-methyl-quinolin-2-yl}-methyl-amino)-ethyl ester


name: 2-[4-(4-Cyclohexyl phenyl)-3-fluorophenyl] propanoic acid


name: 5-[3-(4-tert-Butyl-benzyl)-thioureidomethyl]-2-methanesulfonylamino-benzoic acid methyl ester


name: {4-[3-(4-tert-Butyl-benzyl)-thioureidomethyl]-2-fluoro-phenylamino}-acetic acid methyl ester


name: 5-[3-(4-tert-Butyl-benzyl)-ureidomethyl]-2-methanesulfonylamino-benzoic acid methyl ester


name: TRXR3_HUMAN Thioredoxin reductase 3 (sprot)

description: A thioredoxin reductase 3 that is encoded in the genome of human.


name: 9-Hydroxy-9-(3-pentyloxy-naphthalen-2-yl)-nonanoic acid methyl ester


name: (E)-8-Hydroxy-8-(3-pentyloxy-naphthalen-2-yl)-oct-5-enoic acid methyl ester


name: 8-Hydroxy-8-(2-pentyloxy-quinolin-3-yl)-oct-5-ynoic acid methyl ester


name: 8-Hydroxy-8-(3-pentyloxy-naphthalen-2-yl)-oct-5-ynoic acid methyl ester


name: 8-Hydroxy-8-(2-pentyloxy-pyridin-3-yl)-oct-5-ynoic acid methyl ester


name: 8-Hydroxy-8-(2-pentyloxy-phenyl)-octanoic acid methyl ester


name: GCN5_YEAST Histone acetyltransferase GCN5 (sprot)

description: A protein that is a translation product of the GCN5 gene in yeast.


name: BCAT1_HUMAN Branched-chain-amino-acid aminotransferase, cytosolic (sprot)

description: A branched-chain-amino-acid aminotransferase, cytosolic that is encoded in the genome of human.


name: BCAT2_RAT Branched-chain-amino-acid aminotransferase, mitochondrial (sprot)

description: A branched-chain-amino-acid aminotransferase, mitochondrial that is encoded in the genome of rat.


name: BCAT1_RAT Branched-chain-amino-acid aminotransferase, cytosolic (sprot)

description: A branched-chain-amino-acid aminotransferase, cytosolic that is encoded in the genome of rat.


name: 3-(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyrazin-6-yl)-benzoic acid ethyl ester


name: 4-[3-(4-{Ethyl-[2-(4-methanesulfonyl-phenyl)-acetyl]-amino}-piperidin-1-yl)-1-phenyl-propyl]-benzoic acid methyl ester


A member of the class of coumarins that is 2H-chromen-2-one substituted by 4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl, methyl, and diethylamino groups at positions 3, 4 and 7, respectively. It is a thiol-reactive fluorescent dye.


A member of the class of benzaldehydes carrying a diethylamino substituent at position 4.


name: ERAP1_HUMAN Endoplasmic reticulum aminopeptidase 1 (sprot)

description: An endoplasmic reticulum aminopeptidase 1 that is encoded in the genome of human.


name: ERAP2_HUMAN Endoplasmic reticulum aminopeptidase 2 (sprot)

description: An endoplasmic reticulum aminopeptidase 2 that is encoded in the genome of human.


name: 3-(6-Phenylpyridazin-4-yl)thiophene-2-carboxylic Acid Methyl Ester


name: IL1RA_MOUSE Interleukin-1 receptor antagonist protein (sprot)

description: An interleukin-1 receptor antagonist protein that is encoded in the genome of mouse.


name: TRHR_RAT Thyrotropin-releasing hormone receptor (sprot)

description: A thyrotropin-releasing hormone receptor type 1 that is encoded in the genome of rat.


name: V1AR_MOUSE Vasopressin V1a receptor (sprot)

description: A vasopressin V1a receptor that is encoded in the genome of mouse.


AMPN_ECOLI Aminopeptidase N (sprot)

A bacterial-type aminopeptidase N that is encoded in the genome of Escherichia coli K-12.


name: SCN9A_MOUSE Sodium channel protein type 9 subunit alpha (sprot)

description: A sodium channel protein type 9 subunit alpha that is encoded in the genome of mouse.


name: Ethyl-[2-(2-fluoro-phenyl)-2-(4-methyl-piperazin-1-yl)-ethyl]-carbamic acid methyl ester


name: [2-(2-Fluoro-phenyl)-2-(4-methyl-piperazin-1-yl)-ethyl]-carbamic acid methyl ester


name: ABAH3_ARATH Abscisic acid 8'-hydroxylase 3 (sprot)

description: A protein that is a translation product of the CYP707A3 gene in Arabidopsis thaliana.


A member of the class of benzamides obtained by formal condensation of the carboxy group of 4-phenoxybenzoic acid with the amino group of (pyridin-2-yl)methylamine.


name: BAX_HUMAN Apoptosis regulator BAX (sprot)

description: An apoptosis regulator BAX that is encoded in the genome of human.


name: 4-[3-(2-Fluoro-benzoyl)-ureido]-3-methoxy-benzoic acid methyl ester


A organic heterotetracyclic compound that is ellipticine in which the hydrogen at position 9 has been replaced by a hydroxy group.


name: 4-Amino-5-chloro-2-methoxy-benzoic acid 2-[4-(11-amino-undecanoylamino)-piperidin-1-yl]-ethyl ester


name: AL5AP_MOUSE Arachidonate 5-lipoxygenase-activating protein (sprot)

description: An arachidonate 5-lipoxygenase-activating protein that is encoded in the genome of mouse.


name: PHLP1_HUMAN PH domain leucine-rich repeat-containing protein phosphatase 1 (sprot)

description: A PH domain leucine-rich repeat-containing protein phosphatase that is encoded in the genome of human.


ACTB_XENLA Actin, cytoplasmic 1 (sprot)

A protein that is a translation product of the actb gene in frog.


A member of the class of monohydroxy-1,4-benzoquinones that is embelin in which the hydroxy group at position 5 is replaced by a methoxy group. Isolated from Lysimachia punctata and Embelia ribes, it exhibits antileishmanial activity as well as inhibitory activity towards hepatitis C protease.


Embelin

A member of the class of dihydroxy-1,4-benzoquinones that is 2,5-dihydroxy-1,4-benzoquinone which is substituted by an undecyl group at position 3. Isolated from Lysimachia punctata and Embelia ribes, it exhibits antimicrobial, antineoplastic and inhibitory activity towards hepatitis C protease.


name: MPEG1_HUMAN Macrophage-expressed gene 1 protein (sprot)

description: A macrophage-expressed gene 1 protein that is encoded in the genome of human.


name: (7-Oxo-cyclohept-1-enyl)-acetic acid (E)-propenyl ester


name: PTPA_MYCTU Low molecular weight protein-tyrosine phosphatase A (sprot)

description: A low molecular weight phosphotyrosine protein phosphatase that is encoded in the genome of Mycobacterium tuberculosis H37Rv.


name: ALF_ECOLI Fructose-bisphosphate aldolase class 2 (sprot)

description: A fructose-bisphosphate aldolase class 2 that is encoded in the genome of Escherichia coli K-12.


name: ALDOA_RABIT Fructose-bisphosphate aldolase A (sprot)

description: A fructose-bisphosphate aldolase A that is encoded in the genome of rabbit.


name: FTSZ_MYCTU Cell division protein FtsZ (sprot)


name: FTSZ_BACSU Cell division protein FtsZ (sprot)

description: A cell division protein FtsZ that is encoded in the genome of Bacillus subtilis subsp. subtilis str. 168.


epi-maslinic acid

A pentacyclic triterpenoid that is 3alpha-hydroxy epimer of  maslinic acid. Isolated from  Prunella vulgaris and Isodon japonicus, it exhibits anti-inflammatory activity.


MASLINIC ACID

A pentacyclic triterpenoid that is olean-12-ene substituted by hydroxy groups at positions 2 and 3 and a carboxy group at position 28 (the 2alpha,3beta stereoisomer). It is isolated from Olea europaea and Salvia canariensis and exhibits anti-inflammatory, antioxidant and antineoplastic activity.


PENTHIOPYRAD

A racemate comprising equimolar amounts of (R)- and (S)-penthiopyrad. Used to control rust and Rhizoctonia diseases and also shows activity against grey mould, powdery mildew and apple scab.


name: DHSD_PIG Succinate dehydrogenase [ubiquinone] cytochrome b small subunit, mitochondrial (sprot)


name: C560_PIG Succinate dehydrogenase cytochrome b560 subunit, mitochondrial (sprot)


PHLOROISOBUTYROPHENONE

A 2-acylphloroglucinol in which the acyl group is specified as isobutyryl.


name: DCMC_HUMAN Malonyl-CoA decarboxylase, mitochondrial (sprot)

description: A malonyl-CoA decarboxylase, mitochondrial that is encoded in the genome of human.


name: MURD_STRPN UDP-N-acetylmuramoylalanine--D-glutamate ligase (sprot)


name: 3-Cyano-5-hydroxymethyl-4-(4-phenoxy-phenylamino)-pyrrolo[1,2-b]pyridazine-6-carboxylic Acid Ethyl Ester


name: 3-Cyano-5-methyl-4-(4-phenoxy-phenylamino)pyrrolo[1,2-b]pyridazine-6-carboxylic acid ethyl ester


name: 1-(2-chloro-2-phenyl-ethyl)-4-(2-p-tolyl-ethylamino)-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid methyl ester


name: 1-(2-chloro-2-phenyl-ethyl)-4-(2-p-tolyl-ethylamino)-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid isopropyl ester


name: 1-(2-chloro-2-phenyl-ethyl)-4-(2-p-tolyl-ethylamino)-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester


name: ALD1_RAT Aldo-keto reductase family 1 member B7 (sprot)

description: An aldo-keto reductase family 1 member B7 that is encoded in the genome of rat.


indole-1-acetic acid

An indolyl carboxylic acid that is acetic acid in which one of the methyl hydrogens is substituted by an indol-1-yl group.


name: ACHE_HUMAN Acetylcholine receptor subunit epsilon (sprot)

description: An acetylcholine receptor subunit epsilon that is encoded in the genome of human.


name: MAOX_HUMAN NADP-dependent malic enzyme (sprot)

description: An NADP-dependent malic enzyme that is encoded in the genome of human.


name: LASR_PSEAE Transcriptional activator protein LasR (sprot)

description: A protein that is a translation product of the lasR gene in Pseudomonas aeruginosa PAO1.


An N-acyl-L-homoserine lactone having 3-oxododecanoyl as the acyl substituent.


name: PP1G_HUMAN Serine/threonine-protein phosphatase PP1-gamma catalytic subunit (sprot)

description: A serine/threonine-protein phosphatase PP1-gamma catalytic subunit that is encoded in the genome of human.


A monohydroxyacetophenone carrying a hydroxy substituent at position 4'.


A  hydroxybenzaldehyde that is benzaldehyde substituted with a hydroxy group at position C-4.


name: {(S)-1-[(pyrrolidine-1-carbonyl)-hydrazonomethyl]-pentyl}-carbamic acid tert-butyl ester


name: [(S)-1-(isopropylsulfanylcarbonyl-hydrazonomethyl)-pentyl]-carbamic acid tert-butyl ester


name: {(S)-1-[(morpholine-4-carbonyl)-hydrazonomethyl]-pentyl}-carbamic acid tert-butyl ester


name: {(S)-1-[(2,3-dihydro-indole-1-carbonyl)-hydrazonomethyl]-pentyl}-carbamic acid tert-butyl ester


name: {(S)-1-[(piperidine-1-carbonyl)-hydrazonomethyl]-pentyl}-carbamic acid tert-butyl ester


name: {(S)-1-[(3,4-dihydro-1H-isoquinoline-2-carbonyl)-hydrazonomethyl]-pentyl}-carbamic acid tert-butyl ester


name: {(S)-1-[(2,3-dihydro-indole-1-carbonyl)-hydrazonomethyl]-pentyl}-carbamic acid 1-benzyl-cyclopentyl ester


name: {(S)-1-[(3,4-dihydro-2H-quinoline-1-carbonyl)-hydrazonomethyl]-pentyl}-carbamic acid tert-butyl ester


name: {(S)-3-methyl-1-[(morpholine-4-carbonyl)-hydrazonomethyl]-butyl}-carbamic acid tert-butyl ester


name: {(S)-1-[(2,2,2-trifluoro-acetyl)-hydrazonomethyl]-pentyl}-carbamic acid tert-butyl ester


name: {(S)-1-[(3-methyl-butyryl)-hydrazonomethyl]-pentyl}-carbamic acid tert-butyl ester


name: N''-[(S)-2-tert-butoxycarbonylamino-hexylidene]-hydrazinecarboxylic acid isopropyl ester


name: {(S)-1-[(4,5-dihydro-thiazol-3-yl)-hydrazonomethyl]-pentyl}-carbamic acid tert-butyl ester


name: [(S)-1-(benzoyl-hydrazonomethyl)-pentyl]-carbamic acid tert-butyl ester


name: DPO3_STAAU DNA polymerase III PolC-type (sprot)


HELD_ECOLI DNA helicase IV (sprot)

A DNA helicase IV that is encoded in the genome of Escherichia coli K-12.


name: DYRK4_HUMAN Dual specificity tyrosine-phosphorylation-regulated kinase 4 (sprot)

description: A dual specificity tyrosine-phosphorylation-regulated kinase 4 that is encoded in the genome of human.


name: 2-Cyano-3-(3,4-dihydroxyphenyl)acrylic acid 2-[2-cyano-3-(3,4-dihydroxyphenyl)acryloyloxy]-propyl ester


name: 2-Cyano-3-(3,4-dihydroxyphenyl)acrylic acid 2-[2-cyano-3-(3,4-dihydroxyphenyl)acryloyloxy]ethyl ester


A polyphenol that is (-)-secoisolariciresinol carrying an additional hydroxy substituent at position 7.


dutasteride

An aza-steroid that is inasteride in which the tert-butyl group is replaced by a 2,5-bis(trifluoromethyl)phenyl group. A synthetic 4-azasteroid, dutasteride is a selective inhibitor of both the type 1 and type 2 isoforms of steroid 5alpha-reductase, an intracellular enzyme that converts testosterone to 5alpha-dihydrotestosterone. Dutasteride is used for the treatment of symptomatic benign prostatic hyperplasia in men with an enlarged prostate gland.


netupitant

A monocarboxylic acid amide obtained by formal condensation of the carboxy group of 2-[3,5-bis(trifluoromethyl)phenyl]-2-methylpropanoic acid with the secondary amino group of N-methyl-4-(2-methylphenyl)-6-(4-methylpiperazin-1-yl)pyridin-3-amine; an antiemetic used in combination with palonosetron hydrochloride (under the trade name Akynzeo) to treat nausea and vomiting in patients undergoing cancer chemotherapy.


name: 8-Amino-4-oxo-4,5-dihydro-[1,2,4]triazolo[1,5-a]quinoxaline-2-carboxylic acid ethyl ester


name: benzoic acid 2-[[(3S,4R)-4-(4-chlorophenyl)-1-methyl-piperidin-3-yl]methylsulfanyl]ethyl ester


name: acetic acid 2-[[(3S,4R)-4-(4-chlorophenyl)-1-methyl-piperidin-3-yl]methylsulfanyl]ethyl ester


name: acetic acid 2-[[(3S,4S)-4-(4-chlorophenyl)-1-methyl-piperidin-3-yl]methylsulfanyl]ethyl ester


name: F262_HUMAN 6-phosphofructo-2-kinase/fructose-2,6-bisphosphatase 2 (sprot)

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


An organic heterotricyclic compound resulting from the formal fusion of the 2-3 bond of 5-chloroindole with the 2-3 bond of cycloheptanecarboxamide (the S enantiomer). It is a potent, cell-permeable, metabolically stable and selective inhibitor of the deacetylase SIRT1.


A member of the class of bipyridines that is 4,4'-bipyridine substituted at positions 2 and 2' by 4-fluoroaminophenyl and 4-methoxycyclohexanecarboxamido groups respectively.


A member of the class of pyridines that is pyridine substituted by a 3-oxo-3-(pyridin-4-yl)prop-1-en-1-yl group at position 3. An inhibitor of PFKFB3 kinase, an enzyme with a key role in glycolysis.


name: PARC_STAAU DNA topoisomerase 4 subunit A (sprot)


gemifloxacin

A 1,4-dihydro-1,8-naphthyridine with a carboxy group at the 3-position, an oxo sustituent at the 4-position, a fluoro substituent at the 5-position and a substituted pyrrolin-1-yl group at the 7-position.


name: F261_HUMAN 6-phosphofructo-2-kinase/fructose-2,6-bisphosphatase 1 (sprot)

description: A 6-phosphofructo-2-kinase/fructose-2,6-bisphosphatase 1 that is encoded in the genome of human.


nostocarboline

A member of the class of beta-carbolines that is 9H-beta-carbolin-2-ium substituted by a chloro group at position 6 and a methyl group at position 2. It is isolated from a fresh water cyanobacterium Nostoc 78-12A and acts as an inhibitor of butyrylcholinesterase.


name: CA2D1_MOUSE Voltage-dependent calcium channel subunit alpha-2/delta-1 (sprot)

description: A voltage-dependent calcium channel subunit alpha-2/delta-1 that is encoded in the genome of mouse.


ETHIONINE

An S-ethylhomocysteine that has S-configuration at the chiral centre.


D-alpha-phenylglycine

The R stereoisomer of alpha-phenylglycine.


L-alpha-phenylglycine

The S stereoisomer of alpha-phenylglycine.


name: GBRB_MUSDO Gamma-aminobutyric acid receptor subunit beta (sprot)


name: (-)-3-Hydroxy-N-cyclobutylmethylmorphinan S(+)-Mandelate (MCL 101)


name: 8-(n-Butylamino)adenosine 5'-triphosphate;tetra sodium salt.


name: 2-(n-Butoxy)adenosine 5'-triphosphate;tetra sodium salt.


name: 2-(n-Butylamino)adenosine 5'-triphosphate;tetra sodium salt.


name: 8-(n-Butylthioether)adenosine 5'-triphosphate;tetra sodium salt.


name: 2-(n-Butylthioether)adenosine 5'-triphosphate;tetra sodium salt.


name: (2-Chloropurin-9-yl)-3,4-dihydroxytetrahydrothiphene-2-carboxylic acid methyl amide


hispidol

A hydroxyaurone that is aurone substituted by hydroxy groups at positions 6 and 4' respectively.


thiabendazole

A member of the class of benzimidazoles carrying a 1,3-thiazol-4-yl substituent at position 2. A mainly post-harvest fungicide used to control a wide range of diseases including Aspergillus, Botrytis, Cladosporium and Fusarium.


andrographolide

A labdane diterpenoid isolated from the leaves and roots of Andrographis paniculata that exhibits anti-HIV, anti-inflammatory and antineoplastic properties.


A member of the class of indazoles that is 2H-indazole substituted by 4-(piperidin-3-yl)phenyl and aminocarbonyl groups at positions 2 and 7, respectively. It is a potent PARP1 inhibitor with IC50 of 3.2 nM.


tectorigenin

A methoxyisoflavone that is  isoflavone substituted by a methoxy group at position 6 and hydroxy groups at positions 5, 7 and 4' respectively.


MILLEWANIN G

A member of the class of 7-hydroxyisoflavones that is isoflavone substituted by hydroxy groups at positions 5, 7, 3' and 4', a prenyl group at position 8 and a 2-hydroxy-3-methylbut-3-enyl moiety at position 6. Isolated from the leaves of Millettia pachycarpa, it exhibits antiestrogenic activity.


(+/-)-FUROWANIN B

A hydroxyisoflavone that is 8,9-dihydro-4H-furo[2,3-h]chromen-4-one substituted by a hydroxy group at position 5, a 3,4-dihydroxyphenyl group at position 3, a 2-hydroxypropan-2-yl group at position 8 and a prenyl group at position 6. Isolated from Millettia pachycarpa, it exhibits anti-estrogenic activity.


millewanin H

A hydroxyisoflavone that is isoflavone substituted by hydroxy groups at positions 5, 7, 3' and 4', a prenyl group at position 6 and a 2-hydroxy-3-methylbut-3-enyl moiety at position 8. Isolated from the leaves of Millettia pachycarpa, it exhibits antiestrogenic activity.


name: PE2R2_RAT Prostaglandin E2 receptor EP2 subtype (sprot)

description: A prostaglandin E2 receptor EP2 subtype that is encoded in the genome of rat.


name: PLPL2_MOUSE Patatin-like phospholipase domain-containing protein 2 (sprot)

description: A patatin-like phospholipase domain-containing protein 2 that is encoded in the genome of mouse.


PLPP_MOUSE Chronophin (sprot)

A pyridoxal phosphate phosphatase that is encoded in the genome of mouse.


name: S28A2_HUMAN Sodium/nucleoside cotransporter 2 (sprot)

description: A sodium/nucleoside cotransporter 2 that is encoded in the genome of human.


name: CD38_MOUSE ADP-ribosyl cyclase/cyclic ADP-ribose hydrolase 1 (sprot)

description: An ADP-ribosyl cyclase/cyclic ADP-ribose hydrolase 1 that is encoded in the genome of mouse.


name: Methanesulfonic acid 5-[(2-methyl-4-thiazolyl)ethynyl]-2-pyridyl ester


name: HG2A_HUMAN HLA class II histocompatibility antigen gamma chain (sprot)

description: An MHC class II histocompatibility antigen gamma chain that is encoded in the genome of human.


name: AROQ_HELPY 3-dehydroquinate dehydratase (sprot)

description: A protein that is a translation product of the aroQ gene in Helicobacter pylori 26695.


ENPL_PIG Endoplasmin (sprot)

An endoplasmin that is encoded in the genome of pig.


name: KCNA4_HUMAN Potassium voltage-gated channel subfamily A member 4 (sprot)

description: A voltage-gated potassium channel alpha subunit KCNA4 that is encoded in the genome of human.


name: PTPRR_HUMAN Receptor-type tyrosine-protein phosphatase R (sprot)

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


name: N-(2,4-dimethoxybenzyl)-N-isobutylpiperidin-4-amine fumaric acid salt


name: N-(4-fluoro-2-(trifluoromethyl)benzyl)-N-isobutylpiperidin-4-amine fumaric acid salt


name: 4-((Isobutyl(piperidin-4-yl)amino)methyl)benzonitrile fumaric acid salt


name: N-(2-(trifluoromethyl)benzyl)-N-(3-methoxypropyl)piperidin-4-amine tartaric acid salt


name: N-(3-(trifluoromethyl)benzyl)-N-isobutylpiperidin-4-amine fumaric acid salt


name: N-(2,4-dimethylbenzyl)-N-isobutylpiperidin-4-amine fumaric acid salt


name: Isobutyl-(2-methyl-benzyl)-piperidin-4-yl-amine fumaric acid salt


name: N-(4-fluorobenzyl)-N-isobutylpiperidin-4-amine fumaric acid salt


name: N-(2-(trifluoromethyl)benzyl)-N-isopropylpiperidin-4-amine fumaric acid salt


name: N-(2-methoxybenzyl)-N-isobutylpiperidin-4-amine fumaric acid salt


name: N-(2-fluorobenzyl)-N-isobutylpiperidin-4-amine fumaric acid salt


name: N-(2-fluoro-4-(trifluoromethyl)benzyl)-N-isobutylpiperidin-4-amine fumaric acid salt


name: N-(2-(trifluoromethyl)benzyl)-N-butylpiperidin-4-amine fumaric acid salt


name: N-(4-fluoro-2-(trifluoromethyl)benzyl)-N-propylpiperidin-4-amine fumaric acid salt


name: 4-((2-(Trifluoromethyl)benzyl)(piperidin-4-yl)amino)butanenitrile tartaric acid salt


name: N-(2-chloro-3-(trifluoromethyl)benzyl)-N-isobutylpiperidin-4-amine fumaric acid salt


name: N-(2-(trifluoromethyl)benzyl)-N-cyclopentylpiperidin-4-amine fumaric acid salt


name: 1-(2-Cyclohexyl-4-methylpentyl)-3-ethynylbenzene fumaric acid salt


name: Isobutyl-(3-methyl-benzyl)-piperidin-4-yl-amine fumaric acid salt


name: 3-((4-Fluoro-2-(trifluoromethyl)benzyl)(piperidin-4-yl)amino)propanenitrile tartaric acid salt


name: 2-((4-Fluoro-2-(trifluoromethyl)benzyl)(piperidin-4-yl)amino)ethanol fumaric acid salt


name: N-(2-(trifluoromethyl)benzyl)-N-(pentan-3-yl)piperidin-4-amine fumaric acid salt


name: N-(5-fluoro-2-methoxybenzyl)-N-isobutylpiperidin-4-amine fumaric acid salt


name: N-(2-(trifluoromethyl)benzyl)-N-(3,3,3-trifluoropropyl)piperidin-4-amine fumaric acid salt


name: N-(4-fluoro-2-(trifluoromethyl)benzyl)-N-butylpiperidin-4-amine fumaric acid salt


name: N-(4-fluoro-2-(trifluoromethyl)benzyl)-N-(3-methoxypropyl)piperidin-4-amine tartaric acid salt


name: 3-((4-Fluoro-2-(trifluoromethyl)benzyl)(piperidin-4-yl)amino)-2,2-dimethylpropanenitrile tartaric acid salt


name: N-(4-(trifluoromethyl)benzyl)-N-isobutylpiperidin-4-amine fumaric acid salt


name: N-(2-(trifluoromethyl)benzyl)-N-(2,2,2-trifluoroethyl)piperidin-4-amine tartaric acid salt


name: N-(2-(trifluoromethyl)benzyl)-N-neopentylpiperidin-4-amine fumaric acid salt


name: N-(2-(trifluoromethyl)benzyl)-N-(2-methoxyethyl)piperidin-4-amine fumaric acid salt


name: N-(5-fluoro-2-(trifluoromethyl)benzyl)-N-isobutylpiperidin-4-amine fumaric acid salt


name: N-(4-fluoro-2-(trifluoromethyl)benzyl)-N-(2-ethoxyethyl)piperidin-4-amine tartaric acid salt


name: N-(2-(trifluoromethoxy)benzyl)-N-isobutylpiperidin-4-amine fumaric acid salt


name: N-(2,4-difluorobenzyl)-N-isobutylpiperidin-4-amine fumaric acid salt


name: N-(2-(trifluoromethyl)benzyl)-N-(2-ethylbutyl)piperidin-4-amine fumaric acid salt


name: 2-((Isobutyl(piperidin-4-yl)amino)methyl)benzonitrile fumaric acid salt


name: N-(4-fluoro-2-(trifluoromethyl)benzyl)-N-(2-isopropoxyethyl)piperidin-4-amine tartaric acid salt


name: N-(2,5-dichlorobenzyl)-N-isobutylpiperidin-4-amine fumaric acid salt


name: N-(2-(methylthio)benzyl)-N-isobutylpiperidin-4-amine fumaric acid salt


name: 1-((4-Fluoro-2-(trifluoromethyl)benzyl)(piperidin-4-yl)amino)-2-methylpropan-2-ol tartaric acid salt


name: 4-((4-Fluoro-2-(trifluoromethyl)benzyl)(piperidin-4-yl)amino)-2-methylbutan-2-ol tartaric acid salt


name: N-(2-chloro-5-(trifluoromethyl)benzyl)-N-isobutylpiperidin-4-amine fumaric acid salt


name: N-(4-fluoro-2-(trifluoromethyl)benzyl)-N-(cyclobutylmethyl)piperidin-4-amine tartaric acid salt


name: Piperidin-4-yl-(2-trifluoromethoxy-ethyl)-(2-trifluoromethyl-benzyl)-amine tartaric acid salt


name: N-(2,4-dichlorobenzyl)-N-isobutylpiperidin-4-amine fumaric acid salt


name: N-(3-fluorobenzyl)-N-isobutylpiperidin-4-amine fumaric acid salt


name: N-(2-(trifluoromethyl)benzyl)-N-propylpiperidin-4-amine fumaric acid salt


name: 4-((4-Fluoro-2-(trifluoromethyl)benzyl)(piperidin-4-yl)amino)butanenitrile tartaric acid salt


name: N-(2-fluoro-6-(trifluoromethyl)benzyl)-N-isobutylpiperidin-4-amine fumaric acid salt


name: SCN7A_HUMAN Sodium channel protein type 7 subunit alpha (sprot)

description: A sodium channel protein type 7 subunit alpha that is encoded in the genome of human.


propafenone

An aromatic ketone that is 3-(propylamino)propane-1,2-diol in which the hydrogen of the primary hydroxy group is replaced by a 2-(3-phenylpropanoyl)phenyl group. It is a class 1C antiarrhythmic drug with local anesthetic effects, and is used as the hydrochloride salt in the management of supraventricular and ventricular arrhythmias.


OCHNAFLAVONE

A biflavonoid with an ether linkage between the B-rings of the apigenin and luteolin subunits. It has been isolated from several members of the Ochnaceae plant family.


name: CAC1C_CAVPO Voltage-dependent L-type calcium channel subunit alpha-1C (sprot)


name: ALF_TRYBB Fructose-bisphosphate aldolase, glycosomal (sprot)


name: 4-{(Morpholine-4-carbonyl)-[4-(2,2,2-trifluoro-1-hydroxy-1-trifluoromethylethyl)phenyl]amino}butyric acid methyl ester


name: 3-{(Morpholine-4-carbonyl)-[4-(2,2,2-trifluoro-1-hydroxy-1-trifluoromethylethyl)phenyl]amino}propionic acid methyl ester


name: {(3-Phenylpropionyl)-[4-(2,2,2-trifluoro-1-hydroxy-1-trifluoromethylethyl)phenyl]amino}acetic acid methyl ester


name: {Isobutyryl-[4-(2,2,2-trifluoro-1-hydroxy-1-trifluoromethylethyl)phenyl]amino}acetic acid methyl ester


name: 5-{(Morpholine-4-carbonyl)-[4-(2,2,2-trifluoro-1-hydroxy-1-trifluoromethylethyl)phenyl]amino}pentanoic acid methyl ester


name: {(Morpholine-4-carbonyl)-[4-(2,2,2-trifluoro-1-hydroxy-1-trifluoromethylethyl)phenyl]amino}acetic acid methyl ester


name: PP2BB_HUMAN Serine/threonine-protein phosphatase 2B catalytic subunit beta isoform (sprot)

description: A serine/threonine-protein phosphatase 2B catalytic subunit beta isoform that is encoded in the genome of human.


name: KCND3_HUMAN Potassium voltage-gated channel subfamily D member 3 (sprot)

description: A voltage-gated potassium channel KCND3 that is encoded in the genome of human.


everolimus

A macrocyclic lactone that is rapamycin in which the hydroxy group attached to the cyclohexyl moiety has been converted into the corresponding 2-hydroxyethyl ether. It is an immunosuppressant and antineoplastic agent.


lamotrigine

A member of the class of 1,2,4-triazines in which the triazene skeleton is substituted by amino groups at positions 3 and 5, and by a 2,3-dichlorophenyl group at position 6.


telbivudine

A pyrimidine 2'-deoxyribonucleoside that is the L-enantiomer of thymine. A synthetic thymidine nucleoside analogue with activity against HBV DNA polymerase.


nicardipine

A dihydropyridine that is 1,4-dihydropyridine substituted by a methyl, {2-[benzyl(methyl)amino]ethoxy}carbonyl, 3-nitrophenyl, methoxycarbonyl and methyl groups at positions 2, 3, 4, 5 and 6, respectively.


CARNOSIC ACID

An abietane diterpenoid that is abieta-8,11,13-triene substituted by hydroxy groups at positions 11 and 12 and a carboxy group at position 20. It is isolated from rosemary (Rosmarinus officinalis) and common sage (Salvia officinalis) and exhibits anti-angiogenic, antineoplastic, antioxidant and anti-HIV activity.


linoleate

An octadecadienoate with cis- double bonds at the 9- and 12- positions; the conjugate base of linoleic acid.


name: AAAD_HUMAN Arylacetamide deacetylase (sprot)

description: An arylacetamide deacetylase that is encoded in the genome of human.


METACETAMOL

A derivative of phenol which has an acetamido substituent located meta to the phenolic -OH group. It is a non-toxic regioisomer of paracetamol with analgesic properties, but has never been marketed as a drug.


name: (+/-)-JWH 018 N-(4-hydroxypentyl) metabolite


artemisinin

A sesquiterpene lactone obtained from sweet wormwood, Artemisia annua, which is used as an antimalarial for the treatment of multi-drug resistant strains of falciparum malaria.


name: UD19_HUMAN UDP-glucuronosyltransferase 1A9 (sprot)

description: A UDP-glucuronosyltransferase 1A9 that is encoded in the genome of human.


name: UD110_HUMAN UDP-glucuronosyltransferase 1A10 (sprot)

description: A UDP-glucuronosyltransferase 1A10 that is encoded in the genome of human.


name: UD18_HUMAN UDP-glucuronosyltransferase 1A8 (sprot)

description: A UDP-glucuronosyltransferase 1A8 that is encoded in the genome of human.


name: UDB17_HUMAN UDP-glucuronosyltransferase 2B17 (sprot)

description: A UDP-glucuronosyltransferase 2B17 that is encoded in the genome of human.


An indan-1-ol in which the carbon bearing the hydroxy group has S configuration.


name: SO2B1_HUMAN Solute carrier organic anion transporter family member 2B1 (sprot)

description: A solute carrier organic anion transporter family member 2B1 that is encoded in the genome of human.


name: NR1I2_RAT Nuclear receptor subfamily 1 group I member 2 (sprot)

description: A nuclear receptor subfamily 1 group I member 2 that is encoded in the genome of rat.


dimercaprol

A dithiol that is propane-1,2-dithiol in which one of the methyl hydrogens is replaced by a hydroxy group. a chelating agent originally developed during World War II as an experimental antidote against the arsenic-based poison gas Lewisite, it has been used clinically since 1949 for the treatment of poisoning by arsenic, mercury and gold. It can also be used for treatment of poisoning by antimony, bismuth and possibly thallium, and (with sodium calcium edetate) in cases of acute leaad poisoning. Administration is by (painful) intramuscular injection of a suspension of dimercaprol in peanut oil, typically every 4 hours for 2-10 days depending on the toxicity. In the past, dimercaprol was also used for the treatment of Wilson's disease, a severely debilitating genetic disorder in which the body tends to retain copper, with resultant liver and brain injury.


fluorometholone

A member of the class of glucocorticoids that is Delta(1)-progesterone substituted at positions 11beta and 17 by hydroxy groups, at position 6alpha by a methyl group and at position 9 by a fluoro group. Used for the treatment of corticosteroid-responsive inflammation of the palpebral and bulbar conjunctiva, cornea and anterior segment of the globe.


droxidopa

A serine derivative that is L-serine substituted at the beta-position by a 3,4-dihydroxyphenyl group. A prodrug for noradrenalone, it is used for treatment of neurogenic orthostatic hypotension


ciglitazone

An aromatic ether that consists of 1,3-thiazolidine-2,4-dione with position 5 substituted by a 4-[(1-methylcyclohexyl)methoxy]benzyl group. A selective PPARgamma agonist.


dioscin

A spirostanyl glycoside that consists of the trisaccharide alpha-L-Rha-(1->4)-[alpha-L-Rha-(1->2)]-beta-D-Glc attached to position 3 of diosgenin via a glycosidic linkage.


name: ATS1_HUMAN A disintegrin and metalloproteinase with thrombospondin motifs 1 (sprot)

description: An a disintegrin and metalloproteinase with thrombospondin motifs 1 that is encoded in the genome of human.


irilone

A hydroxyisoflavone that is 6,7-methylenedioxyisoflavone substituted by hydroxy groups at positions 5 and 4'.


name: UD17_HUMAN UDP-glucuronosyltransferase 1A7 (sprot)

description: A protein that is a translation product of the UGT1A7 gene in human.


name: UD13_HUMAN UDP-glucuronosyltransferase 1A3 (sprot)

description: A UDP-glucuronosyltransferase 1A3 that is encoded in the genome of human.


name: MRP4_HUMAN ATP-binding cassette sub-family C member 4 (sprot)

description: An ATP-binding cassette sub-family C member 4 that is encoded in the genome of human.


CP3A7_HUMAN Cytochrome P450 3A7 (sprot)

A cytochrome P450 3A7 that is encoded in the genome of human.


name: PO2F1_HUMAN POU domain, class 2, transcription factor 1 (sprot)

description: A POU domain, class 2, transcription factor 1 that is encoded in the genome of human.


A member of the class of diazepinoindoles that is 1,2,3,4-tetrahydro[1,4]diazepino[6,7,1-hi]indole substituted by piperidin-1-ylcarbonyl, 4-(imidazo[1,2-a]pyridin-3-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl and fluoro groups at position 2, 7 and 9, respectively. It is a potent ATP-competitive inhibitor of glycogen synthase kinase-3 (GSK-3) with IC50 values of 1.5 nM and 0.9 nM for GSK-3alpha and GSK-3beta. The drug is in clinical development for the treatment of advanced/metastatic cancer.


A imidazolidine-2,4-dione that consists of hydantoin bearing phenyl and 4-hydroxyphenyl substituents at position 5.


The L-enantiomer of thyroxine.


A member of the class of pyranoindolizinoquinolines that is (4S)-pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14-dione bearing two additional ethyl substituents at positions 4 and 11 as well as two additional hydroxy substituents at positions 4 and 9. It is the active metabolite of irinotecan and is ~1000 times more active than irinotecan itself.


name: S15A1_RAT Solute carrier family 15 member 1 (sprot)

description: A solute carrier family 15 member 1 that is encoded in the genome of rat.


name: S15A1_MOUSE Solute carrier family 15 member 1 (sprot)

description: A solute carrier family 15 member 1 that is encoded in the genome of mouse.


name: S22A6_HUMAN Solute carrier family 22 member 6 (sprot)

description: A solute carrier family 22 member 6 that is encoded in the genome of human.


EPIESTRIOL

A 3-hydroxy steroid that is 17beta-estradiol substituted by a beta-hydroxy group at position 16.


diclofenac beta-D-glucosiduronic acid

A beta-D-glucosiduronic acid (beta-D-glucuronide) that is a metabolite of diclofenac.


name: S28A3_HUMAN Solute carrier family 28 member 3 (sprot)

description: A solute carrier family 28 member 3 that is encoded in the genome of human.


uridine

A ribonucleoside composed of a molecule of uracil attached to a ribofuranose moiety via a beta-N(1)-glycosidic bond.


name: S28A1_HUMAN Sodium/nucleoside cotransporter 1 (sprot)

description: A sodium/nucleoside cotransporter 1 that is encoded in the genome of human.


name: S29A2_HUMAN Equilibrative nucleoside transporter 2 (sprot)

description: An equilibrative nucleoside transporter 2 that is encoded in the genome of human.


name: MTAP2_HUMAN Microtubule-associated protein 2 (sprot)

description: A microtubule-associated protein 2 that is encoded in the genome of human.


name: ITPR1_RAT Inositol 1,4,5-trisphosphate-gated calcium channel ITPR1 (sprot)

description: An inositol 1,4,5-trisphosphate receptor type 1 that is encoded in the genome of rat.


name: VL1_HPV16 Major capsid protein L1 (sprot)


name: ANM7_HUMAN Protein arginine N-methyltransferase 7 (sprot)

description: A protein arginine N-methyltransferase 7 that is encoded in the genome of human.


name: [Benzyloxycarbonylamino-(4-guanidino-phenyl)-methyl]-phosphonic acid bis-(4-ethyl-phenyl) ester trifluoro-acetic acid salt


name: [Benzyloxycarbonylamino-(4-guanidino-phenyl)-methyl]-phosphonic acid dinaphthalen-2-yl ester trifluoro-acetic acid salt


name: [Benzyloxycarbonylamino-(4-guanidino-phenyl)-methyl]-phosphonic acid diphenyl ester trifluoro-acetic acid salt


name: [Benzyloxycarbonylamino-(4-guanidino-phenyl)-methyl]-phosphonic acid bis-(4-methanesulfonyl-phenyl) ester trifluoro-acetic acid salt


name: [Benzyloxycarbonylamino-(4-guanidino-phenyl)-methyl]-phosphonic acid bis-(4-methylsulfanyl-phenyl) ester trifluoro-acetic acid salt


name: [Benzyloxycarbonylamino-(4-guanidino-phenyl)-methyl]-phosphonic acid bis-[4-(1,1,3,3-tetramethyl-butyl)-phenyl] ester trifluoro-acetic acid salt


name: [Benzyloxycarbonylamino-(4-guanidino-phenyl)-methyl]-phosphonic acid bis-(4-tert-butyl-phenyl) ester trifluoro-acetic acid salt


name: [Benzyloxycarbonylamino-(4-guanidino-phenyl)-methyl]-phosphonic acid bis-(4-methoxy-phenyl) ester trifluoro-acetic acid salt


name: [Benzyloxycarbonylamino-(4-guanidino-phenyl)-methyl]-phosphonic acid bis-(4-isopropyl-phenyl) ester trifluoro-acetic acid salt


name: [Benzyloxycarbonylamino-(4-guanidino-phenyl)-methyl]-phosphonic acid di-p-tolyl ester trifluoro-acetic acid salt


name: LYN_RAT Tyrosine-protein kinase Lyn (sprot)

description: A tyrosine-protein kinase Lyn that is encoded in the genome of rat.


name: FGR_RAT Tyrosine-protein kinase Fgr (sprot)

description: A tyrosine-protein kinase Fgr that is encoded in the genome of rat.


name: Neuropeptide Y (24-36) amide, N-acetyl-(leu(28,31))-


name: GRIK5_RAT Glutamate receptor ionotropic, kainate 5 (sprot)

description: A glutamate receptor ionotropic, kainate 5 that is encoded in the genome of rat.


name: PSB6_YEAST Proteasome subunit beta type-6 (sprot)

description: A proteasome subunit beta type-1 that is encoded in the genome of yeast.


name: PSB5_YEAST Proteasome subunit beta type-5 (sprot)

description: A proteasome subunit beta type-5 that is encoded in the genome of yeast.


name: PSB4_YEAST Proteasome subunit beta type-4 (sprot)

description: A proteasome subunit beta type-2 that is encoded in the genome of yeast.


name: CCR8_HUMAN C-C chemokine receptor type 8 (sprot)

description: A C-C chemokine receptor type 8 that is encoded in the genome of human.


Z-butylidenephthalide

A  gamma-lactone that is  phthalide substituted by a butylidene group at position 3. Isolated from Ligusticum porteri, it exhibits  hypoglycemic activity.


DOCOSAPENTAENOIC ACID

The all-cis-isomer of a C22 polyunsaturated fatty acid having five double bonds in the 7-, 10-, 13-, 16- and 19-positions.


name: S27A4_HUMAN Long-chain fatty acid transport protein 4 (sprot)

description: A long-chain fatty acid transport protein 4 that is encoded in the genome of human.


carbamazepine

A dibenzoazepine that is 5H-dibenzo[b,f]azepine carrying a carbamoyl substituent at the azepine nitrogen, used as an anticonvulsant.


GLAUCINE

An  aporphine alkaloid that is (S)-1,2,9,10-tetrahydroxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline in which the four phenolic hydrogens have been replaced by methyl groups.


name: 4-{4-[5-amino-1-(2,6-difluoro-benzoyl)-1H-[1,2,4]triazol-3-ylamino]-benzenesulfonylamino}-4-oxo-butyric acid ethyl ester


PA21B_MOUSE Phospholipase A2 (sprot)

A phospholipase A2 that is encoded in the genome of mouse.


name: PA2GE_MOUSE Group IIE secretory phospholipase A2 (sprot)

description: A group IIE secretory phospholipase A2 that is encoded in the genome of mouse.


name: PA2GE_HUMAN Group IIE secretory phospholipase A2 (sprot)

description: A group IIE secretory phospholipase A2 that is encoded in the genome of human.


name: PA2G5_MOUSE Phospholipase A2 group V (sprot)

description: A phospholipase A2 group V that is encoded in the genome of mouse.


name: PA2GX_MOUSE Group 10 secretory phospholipase A2 (sprot)

description: A group 10 secretory phospholipase A2 that is encoded in the genome of mouse.


name: 1,2,5-Oxadiazole-3-carboxamide, 4-(hydroxymethyl)-, 2-oxide (9CI)


name: 3-Amino-2-carbamoyl-6-methyl-thieno[2,3-b]pyridine-4-carboxylic acid ethyl ester


name: 3-Amino-6-tert-butyl-2-carbamoyl-thieno[2,3-b]pyridine-4-carboxylic acid ethyl ester


VDR_RAT Vitamin D3 receptor (sprot)

A vitamin D3 receptor that is encoded in the genome of rat.


name: LUXS_ECOLI S-ribosylhomocysteine lyase (sprot)

description: An S-ribosylhomocysteine lyase that is encoded in the genome of Escherichia coli K-12.


name: LUXS_BACSU S-ribosylhomocysteine lyase (sprot)


name: LUXS_VIBC1 S-ribosylhomocysteine lyase (sprot)


L-methionine

The L-enantiomer of methionine.


A limonoid that is 20,21,22,23-tetrahydroazadirone substituted by an additional oxo group at position 23. It has been isolated from Azadirachta indica.


(S,S,S)-nicotianamine

The (S,S,S)-stereoisomer of  nicotianamine.


TRYB1_MOUSE Tryptase (sprot)

A tryptase that is encoded in the genome of mouse.


TRYB1_RAT Tryptase (sprot)

A tryptase that is encoded in the genome of rat.


TRYT_CANLF Tryptase (sprot)

A tryptase alpha/beta-1 that is encoded in the genome of dog.


name: P4HA1_HUMAN Prolyl 4-hydroxylase subunit alpha-1 (sprot)

description: A prolyl 4-hydroxylase subunit alpha-1 that is encoded in the genome of human.


A member of the class of benzimidazoles that is 1H-benzimidazole substituted by (4-benzylpiperidin-1-yl)methyl and (methylsulfonyl)amino groups at positions 2 and 6, respectively. It is a potent antagonist of the GluN2B subunit of the N-methyl-D-aspartate (NMDA) receptor.


FAS_RAT Fatty acid synthase (sprot)

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


name: 4-[5-(2,4-Dioxothiazolidin-5-ylidenemethyl)furan-2-yl]-3-hydroxybenzoic acid methyl ester


name: BHMT1_HUMAN Betaine--homocysteine S-methyltransferase 1 (sprot)

description: A betaine--homocysteine S-methyltransferase 1 that is encoded in the genome of human.


name: (5-Chloro-4-methyl-2-sulfamoyl-benzenesulfonyl)-acetic acid methyl ester


name: 2-(5-Chloro-4-methyl-2-sulfamoyl-benzenesulfonyl)-propionic acid methyl ester


name: 2-Chloro-4-mercapto-5-sulfamoyl-benzoic acid ethyl ester


name: {[5-(2,2,2-Trifluoro-1-hydroxy-1-trifluoromethyl-ethyl)-4,5-dihydro-isoxazole-3-carbonyl]-amino}-acetic acid ethyl ester


name: SCNNA_HUMAN Amiloride-sensitive sodium channel subunit alpha (sprot)

description: An amiloride-sensitive sodium channel subunit alpha that is encoded in the genome of human.


name: 4-{4-[N''-(3,5-diamino-6-chloropyrazine-2-carbonyl)guanidino]-butyl}benzoic acid methyl ester


ROBUSTAFLAVONE

A biflavonoid that is obtained by oxidative coupling of two molecules of  apigenin resulting in a bond between positions C-3 of the hydroxyphenyl ring and C-6 of the chromene ring. Isolated from Thuja orientalis and Rhus succedanea it exhibits antioxidant, cytotoxic and anti-hepatitis B activity.


CUPRESSUFLAVONE

A biflavonoid that is obtained by oxidative coupling of two molecules of apigenin resulting in a bond between positions C-8 of the two chromene rings respectively. Isolated from Cupressus sempervirens and Juniperus occidentalis, it exhibits free radical scavenging and antielastase activities.


ramipril

A dipeptide that is the prodrug for ramiprilat, the active metabolite obtained by hydrolysis of the ethyl ester group. An angiotensin-converting enzyme (ACE) inhibitor, used to treat high blood pressure and congestive heart failure.


name: S15A2_RAT Solute carrier family 15 member 2 (sprot)

description: A solute carrier family 15 member 2 that is encoded in the genome of rat.


Trp-Ala

A dipeptide formed from L-tryptophan and L-alanine residues.


NPM_HUMAN Nucleophosmin (sprot)

A nucleophosmin that is encoded in the genome of human.


PI2R_RAT Prostacyclin receptor (sprot)

A prostacyclin receptor that is encoded in the genome of rat.


L-serine

The L-enantiomer of serine.


name: BLAN_ENTCL Imipenem-hydrolyzing beta-lactamase (sprot)


methamphetamine

A member of the class of amphetamines in which the amino group of (S)-amphetamine carries a methyl substituent.


name: 3-adamantan-1-yl-6-methoxy-1-oxo-1H-indene-2-carboxylic acid ethyl ester


name: 1-oxo-6-phenethyloxy-3-phenyl-1H-indene-2-carboxylic acid ethyl ester


name: 3-furan-3-yl-6-methoxy-1-oxo-1H-indene-2-carboxylic acid ethyl ester


name: 6-benzyloxy-1-oxo-3-phenyl-1H-indene-2-carboxylic acid ethyl ester


name: 6-methoxy-1-oxo-3-phenyl-1H-indene-2-carboxylic acid ethyl ester


name: 1-oxo-3-phenyl-6-(3-phenylpropoxy)-1H-indene-2-carboxylic acid ethyl ester


name: (6-methoxy-1-oxo-3-phenyl-1H-inden-2-yl)acetic acid ethyl ester


name: PK3CA_BOVIN Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (sprot)

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


name: 3-[4-(3-Adamantan-1-yl-ureido)-piperidine-1-carbonyl]-benzoic acid methyl ester


name: VACHT_RAT Vesicular acetylcholine transporter (sprot)

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


name: GDF8_MOUSE Growth/differentiation factor 8 (sprot)

description: A growth/differentiation factor 8 that is encoded in the genome of mouse.


name: INHBA_MOUSE Inhibin beta A chain (sprot)

description: An activin/inhibin beta A chain that is encoded in the genome of mouse.


An aralkylamine that is Nbenzylacetamidine substituted at position 3 on the benzene ring by an aminomethyl group. An inhibitor of nitric oxide synthase.


name: CAC1H_RAT Voltage-dependent T-type calcium channel subunit alpha-1H (sprot)

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


cyclothiazide

3,4-Dihydro-2H-1,2,4-benzothiadiazine 1,1-dioxide substituted at positions 3, 5 and 6 by a 2-norbornen-5-yl group, chlorine, and a sulfonamide group, respectively. A thiazide diuretic, it has been used in the management of hypertension and oedema.


name: Benzeneacetic acid, 2,3-bis((2-chlorophenyl)methoxy)-alpha-hydroxy-, (alphaS)-


name: FYN_MOUSE Tyrosine-protein kinase Fyn (sprot)

description: A tyrosine-protein kinase Fyn that is encoded in the genome of mouse.


name: 6-(3-Adamantan-1-yl-ureido)-hexanoic acid methyl ester


name: TRAF6_HUMAN TNF receptor-associated factor 6 (sprot)

description: A TNF receptor-associated factor 6 that is encoded in the genome of human.


MACLURAXANTHONE B

A member of the class of xanthones  that is 9H-xanthen-9-one substituted by hydroxy groups at positions 1, 3, 6 and 7, a dimethylallyl group at position 2 and a prenyl group at position 4. Isolated from Maclura tinctoria and Cudrania tricuspidata, it exhibits anti-HIV and antineoplastic activity.


name: 2-{[3-(4-methoxy-phenyl)-1-(3-trifluoromethyl-benzyl)-1H-indole-2-carbonyl]-sulfamoyl}-benzoic acid methyl ester


name: PPAC_MOUSE Low molecular weight phosphotyrosine protein phosphatase (sprot)

description: A low molecular weight phosphotyrosine protein phosphatase that is encoded in the genome of mouse.


name: ENPP3_BOVIN Ectonucleotide pyrophosphatase/phosphodiesterase family member 3 (sprot)


name: PPB1_HUMAN Alkaline phosphatase, placental type (sprot)

description: An alkaline phosphatase, placental type that is encoded in the genome of human.


A member of the class of pyridopyrimidines that is pyrido[2,3-d]pyrimidine substituted by methylamino, 5-{[(3,3-dimethylbutyl)carbamoyl]amino}-4-fluoro-2-methylphenyl, and methyl groups at positions 2, 6 and 7, respectively. It is a potent pan RAF inhibitor which inhibits BRAF(V600E), BRAF(WT) and CRAF(WT) (IC50 = 5.8, 9.1 and 15 nM, respectively). It also inhibits RAF homo- and heterodimers and exhibits anti-cancer properties.


dabrafenib

An organofluorine compound and antineoplastic agent, used as its mesylate salt in treatment of metastatic melanoma.


name: MMP13_RAT Collagenase 3 (Fragment) (sprot)

description: A collagenase 3 that is encoded in the genome of rat.


An organic cation consisting of beta-carboline having methyl and hydroxy substituents at the 2- and 6-positions respectively.


name: 3-{3-[4-(4-Fluoro-phenoxy)-cyclohexyl]-ureido}-benzoic acid methyl ester


name: 4-{3-[4-(4-Fluoro-phenoxy)-cyclohexyl]-ureido}-benzoic acid methyl ester


name: N''-[3-(4-methyl-piperazin-1-ylmethyl)-2-phenyl-quinoline-4-carbonyl]-N-phenyl-hydrazinecarboxylic acid methyl ester


name: N''-[3-(4-acetyl-piperazin-1-ylmethyl)-2-phenyl-quinoline-4-carbonyl]-N-phenyl-hydrazinecarboxylic acid methyl ester


name: N-phenyl-N''-(2-phenyl-3-piperidin-4-ylmethyl-quinoline-4-carbonyl)-hydrazinecarboxylic acid methyl ester


name: N''-[3-(4-benzyl-piperazin-1-ylmethyl)-2-phenyl-quinoline-4-carbonyl]-N-phenyl-hydrazinecarboxylic acid methyl ester


name: N''-[3-(4-isopropyl-piperazin-1-ylmethyl)-2-phenyl-quinoline-4-carbonyl]-N-phenyl-hydrazinecarboxylic acid methyl ester


name: N''-[3-(4-cyclohexyl-piperazin-1-ylmethyl)-2-phenyl-quinoline-4-carbonyl]-N-phenyl-hydrazinecarboxylic acid methyl ester


name: N''-[3-(1-tert-butyl-piperidin-4-yloxy)-2-phenyl-quinoline-4-carbonyl]-N-phenyl-hydrazinecarboxylic acid methyl ester


name: 3-[2-(Dim ethylamino)ethoxy]-2-phenyl-4-quinolinecarboxylic acid, 2-(methoxycarbonyl)-2-phenylhydrazide


A 1-acyl-sn-glycerophosphoserine compound having an oleoyl substituent at the 1-hydroxy position.


name: GPR34_HUMAN Probable G-protein coupled receptor 34 (sprot)

description: A probable G-protein coupled receptor 34 that is encoded in the genome of human.


name: P2Y10_HUMAN Putative P2Y purinoceptor 10 (sprot)

description: A putative P2Y purinoceptor 10 that is encoded in the genome of human.


name: GP174_HUMAN Probable G-protein coupled receptor 174 (sprot)

description: A probable G-protein coupled receptor 174 that is encoded in the genome of human.


name: 3-(4-Fluorophenyl)-1-methyl-5-(1-piperazinyl)-4-(4-pyridinyl)-1H-pyrrole-2-carboxylic acid methyl ester


DPO3B_ECOLI Beta sliding clamp (sprot)

A beta sliding clamp that is encoded in the genome of Escherichia coli K-12.


name: ASIC1_HUMAN Acid-sensing ion channel 1 (sprot)

description: An acid-sensing ion channel 1 that is encoded in the genome of human.


name: 2-Thioxo-(1,3)ditholo[4,5-beta][1,4-dithine-5,6-dicarboxylic acid dimethyl ester


name: (4''-{[(2-Dibutylamino-ethyl)-(4-pentyl-benzoyl)-amino]-methyl}-biphenyl-4-yl)-acetic acid methyl ester


22,23-dihydroavermectin B1a

A macrocyclic lactone that is avermectin B1a in which the double bond present in the spirocyclic ring system has been reduced to a single bond. It is the major component of ivermectin.


name: AT1A1_RAT Sodium/potassium-transporting ATPase subunit alpha-1 (sprot)

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


name: AT2A2_RAT Sarcoplasmic/endoplasmic reticulum calcium ATPase 2 (sprot)

description: A sarcoplasmic/endoplasmic reticulum calcium ATPase 2 that is encoded in the genome of rat.


name: AT2A1_RAT Sarcoplasmic/endoplasmic reticulum calcium ATPase 1 (sprot)

description: A sarcoplasmic/endoplasmic reticulum calcium ATPase 1 that is encoded in the genome of rat.


thapsigargin

An organic heterotricyclic compound that is a hexa-oxygenated 6,7-guaianolide isolated fron the roots of Thapsia garganica L., Apiaceae. A potent skin irritant, it is used in traditional medicine as a counter-irritant. Thapsigargin inhibits Ca(2+)-transporting ATPase mediated uptake of calcium ions into sarcoplasmic reticulum and is used in experimentation examining the impacts of increasing cytosolic calcium concentrations.


name: HSPB1_HUMAN Heat shock protein beta-1 (sprot)

description: A heat shock protein beta-1 that is encoded in the genome of human.


name: TRFR_HUMAN Thyrotropin-releasing hormone receptor (sprot)

description: A thyrotropin-releasing hormone receptor type 1 that is encoded in the genome of human.


name: 12-(3-Adamantan-1-yl-ureido)-dodecanoic acid isopropyl ester


name: 12-(3-Adamantan-1-yl-ureido)-dodecanoic acid prop-2-ynyl ester


name: 12-(3-Adamantan-1-yl-ureido)-dodecanoic acid benzyl ester


name: 12-(3-Adamantan-1-yl-ureido)-dodecanoic acid propyl ester


name: 12-(3-Adamantan-1-yl-ureido)-dodecanoic acid ethyl ester


name: 12-(3-Adamantan-1-yl-ureido)-dodecanoic acid allyl ester


name: 12-(3-Adamantan-1-yl-ureido)-dodecanoic acid adamantan-1-yl ester


name: 12-(3-Adamantan-1-yl-ureido)-dodecanoic acid tert-butyl ester


name: 12-(3-Adamantan-1-yl-ureido)-dodecanoic acid methyl ester


name: 12-(3-Adamantan-1-yl-ureido)-dodecanoic acid 2-chloro-benzyl ester


name: 12-(3-Adamantan-1-yl-ureido)-dodecanoic acid isobutyl ester


name: 12-(3-Adamantan-1-yl-ureido)-dodecanoic acid butyl ester


name: 12-(3-Adamantan-1-yl-ureido)-dodecanoic acid naphthalen-1-ylmethyl ester


name: 12-(3-Adamantan-1-yl-ureido)-dodecanoic acid sec-butyl ester


BARETTIN

Natural compound belonging to the class of alpha amino acids and derivatives, found in Geodia barretti


name: CLK2_MOUSE Dual specificity protein kinase CLK2 (sprot)

description: A dual specificity protein kinase CLK2 that is encoded in the genome of mouse.


An indoloquinoline that is 11H-indolo[3,2-c]quinoline substituted by carboxy and iodo groups at positions 6 and 10, respectively. It is a potent inhibitor of DYRK1A (IC50 = 6 nM).


name: CLK4_MOUSE Dual specificity protein kinase CLK4 (sprot)

description: A dual specificity protein kinase CLK4 that is encoded in the genome of mouse.


name: SC6A4_MACMU Sodium-dependent serotonin transporter (sprot)

description: A sodium-dependent serotonin transporter that is encoded in the genome of Macaca mulatta.


name: 3-(3,4-Dichloro-phenyl)-bicyclo[3.2.1]oct-2-ene-2-carboxylic acid methyl ester


name: Uridine 5 inverted exclamation marka-(trihydrogen diphosphate), 2-thio-, P inverted exclamation marka-|A-D-glucopyranosyl ester


name: CXCR3_MOUSE C-X-C chemokine receptor type 3 (sprot)

description: A C-X-C chemokine receptor type 3 that is encoded in the genome of mouse.


ethisterone

A 17beta-hydroxy steroid that is testosterone in which the 17beta hydrogen is replaced by an ethynyl group. Ethisterone was the first orally active progestin and is a metabolite of danazol.


name: BAZ1B_HUMAN Tyrosine-protein kinase BAZ1B (sprot)

description: A bromodomain adjacent to zinc finger domain protein 1B that is encoded in the genome of human.


A secondary carboxamide resulting from the formal condensation of the carboxy group of O-phospho-D-serine with the amino group of m-octylaniline. An analogue of sphingosine-1-phosphate (S1P), it is a potent antagonist for both S1P1 and S1P3 receptors. It can inhibit S1P-induced migration of thyroid cancer cells, ovarian cancer cells, and neural stem cells.


name: BRD8_HUMAN Bromodomain-containing protein 8 (sprot)

description: A bromodomain-containing protein 8 that is encoded in the genome of human.


name: trans-[4-(2,6-dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)-cyclohexyl]-carbamic acid benzyl ester


name: 4-(2,6-dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)-bicyclo[2.2.2]octane-1-carboxylic acid methyl ester


name: CETP_RABIT Cholesteryl ester transfer protein (Fragment) (sprot)


huperzine A

A sesquiterpene alkaloid isolated from a club moss Huperzia serrata that has been shown to exhibit neuroprotective activity. It is also an effective inhibitor of acetylcholinesterase and has attracted interest as a therapeutic candidate for Alzheimer's disease.


EST1_PIG Liver carboxylesterase (sprot)

A protein that is a translation product of the CES1 gene in pig.


name: RPGF4_MOUSE Rap guanine nucleotide exchange factor 4 (sprot)

description: A Rap guanine nucleotide exchange factor 4 that is encoded in the genome of mouse.


name: [1-[(3-bromo-4,5-dihydroisoxazol-5-ylmethyl)carbamoyl]-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl]carbamic acid benzyl ester


name: 2-[(3-Bromo-4,5-dihydroisoxazol-5-ylmethyl)carbamoyl]-2,3-dihydroindole-1-carboxylic acid benzyl ester


name: [1-[(3-bromo-4,5-dihydroisoxazol-5-ylmethyl)carbamoyl]-2-(5-fluoro-1H-indol-3-yl)ethyl]carbamic acid benzyl ester


name: [1-[(3-bromo-4,5-dihydroisoxazol-5-ylmethyl)carbamoyl]-2-(6-fluoro-1H-indol-3-yl)ethyl]carbamic acid benzyl ester


name: [1-[(3-bromo-4,5-dihydroisoxazol-5-ylmethyl)carbamoyl]-2-(4-fluoro-1H-indol-3-yl)ethyl]carbamic acid benzyl ester


name: ((S)-7-benzyl-3-tert-butoxycarbonylmethyl-5-methyl-2,6-dioxo-[1,3,5]triazepan-1-yl)-acetic acid tert-butyl ester


name: PSB9_HUMAN Proteasome subunit beta type-9 (sprot)

description: A proteasome subunit beta type-9 that is encoded in the genome of human.


name: PSB10_HUMAN Proteasome subunit beta type-10 (sprot)

description: A proteasome subunit beta type-10 that is encoded in the genome of human.


ticagrelor

A triazolopyrimidine that is an adenosine isostere; the cyclopentane ring is similar to ribose and the nitrogen-rich [1,2,3]triazolo[4,5-d]pyrimidine moiety resembles the nucleobase adenine. A platelet aggregation inhibitor which is used for prevention of thromboembolic events in patients with acute coronary syndrome.


name: [(1S,2S)-2-azido-1,2-dibenzylethyl]carbamic acid tert-butyl ester


name: DNK_DROME Deoxynucleoside kinase (sprot)

description: A thymidine kinase 2, mitochondrial that is encoded in the genome of fruit fly.


INSR_RAT Insulin receptor (sprot)

An insulin receptor that is encoded in the genome of rat.


name: 3H-Imidazole-4-carboxylic acid, 3-methyl-5-[(pyridin-4-ylmethyl)amino]-, (4-tert-butylphenyl)amide


name: PA2A_CROAD Acidic phospholipase A2 beta (sprot)


name: S6A13_HUMAN Sodium- and chloride-dependent GABA transporter 2 (sprot)

description: A sodium- and chloride-dependent GABA transporter 2 that is encoded in the genome of human.


name: GBA1_BOVIN Lysosomal acid glucosylceramidase (sprot)

description: A lysosomal acid glucosylceramidase that is encoded in the genome of cow.


name: GLP1R_RAT Glucagon-like peptide 1 receptor (sprot)

description: A glucagon-like peptide 1 receptor that is encoded in the genome of rat.


name: ASF1A_HUMAN Histone chaperone ASF1A (sprot)

description: A histone chaperone ASF1A that is encoded in the genome of human.


name: 3MG_HUMAN DNA-3-methyladenine glycosylase (sprot)

description: A DNA-3-methyladenine glycosylase that is encoded in the genome of human.


nimodipine

A dihydropyridine that is 1,4-dihydropyridine which is substituted by methyl groups at positions 2 and 6, a (2-methoxyethoxy)carbonyl group at position 3, a m-nitrophenyl group at position 4, and an isopropoxycarbonyl group at position 5. An L-type calcium channel blocker, it acts particularly on cerebral circulation, and is used both orally and intravenously for the prevention and treatment of subarachnoid hemorrhage from ruptured intracranial aneurysm.


(+)-menthofuran

A menthofuran that is 4,5,6,7-tetrahydro-1-benzofuran substituted by methyl groups at positions 3 and 6 (the 6R-enantiomer).


A member of the class of benzaldehydes that is benzaldehyde carrying a dimethylamino substituent at position 4. Used as an indicator for detection of indoles and hydrazine.


An organic heterobicyclic compound that is (1S,5R)-2-thiabicyclo[3.1.0]hexane carrying oxo, oxo, amino, carboxy, and carboxy groups at positions 2, 2, 4S, 4S, and 6S, respectively. It is a potent agonist of group II metabotropic glutamate receptors mGluR2 mGluR3 (Ki = 149 nM and 92 nM, respectively) and exhibits antipsychotic and anxiolytic efficacy in animal models.


oxedrine

A  phenethylamine alkaloid that is 4-(2-aminoethyl)phenol substituted by a hydroxy group at position 1 and a methyl group at the amino nitrogen.


ITAV_HUMAN Integrin alpha-V (sprot)

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


ERYTHRODIOL

A pentacyclic triterpenoid that is beta-amyrin in which one of the hydrogens of the methyl group at position 28 has been replaced by a hydroxy group. It is a plant metabolite found in olive oil as well as in Rhododendron ferrugineum and other Rhododendron species.


name: 4-thiazolidinecarboxylic acid, 2-undecyl-, (4r)-


name: 4-[4-(Benzylamino-methyl)-naphthalene-1-sulfonylamino]piperidine-1-carboxylic acid ethyl ester


name: 4-(8-Benzoylamino-naphthalene-2-sulfonylamino)-piperidine-1-carboxylic acid ethyl ester


name: 4-(4-o-Tolylcarbamoyl-naphthalene-1-sulfonylamino)-piperidine-1-carboxylic acid ethyl ester


name: 4-(4-Benzoylamino-naphthalene-1-sulfonylamino)-piperidine-1-carboxylic acid tert-butyl ester


name: 4-{4-[(3-Phenyl-propylamino)-methyl]-naphthalene-1-sulfonylamino}-piperidine-1-carboxylic acid ethyl ester


name: 4-(4-Benzoylamino-naphthalene-1-sulfonylamino)-piperidine-1-carboxylic acid ethyl ester


name: 4-(4-Cyclohexylcarbamoyl-naphthalene-1-sulfonylamino)-piperidine-1-carboxylic acid ethyl ester


name: 4-[4-(Phenethylamino-methyl)-naphthalene-1-sulfonylamino]-piperidine-1-carboxylic acid ethyl ester


MONODICTYSIN C

A member of the class of xanthones that is 1,2,3,4,4a,9a-hexahydro-9H-xanthen-9-one substituted by hydroxy groups at positions 1, 4 and 8, methyl groups at positions 3 and 4a and a methoxy group at position 6 (the 1S,3S,4S,4aS,9aS stereoisomer). Isolated from the marine algicolous fungus Monodictys putredinis, it exhibits antineoplastic activity.


glafenine

A carboxylic ester that is 2,3-dihydroxypropyl anthranilate in which the amino group is substituted by a 7-chloroquinolin-4-yl group. A non-steroidal anti-inflammatory drug, glafenine and its hydrochloride salt were used for the relief of all types of pain, but high incidence of anaphylactic reactions resulted in their withdrawal from the market.


clobetasol propionate

The 17-O-propionate ester of clobetasol. A potent corticosteroid, it is used to treat various skin disorders, including exzema and psoriasis.


dicloxacillin

A penicillin that is 6-aminopenicillanic acid in which one of the amino hydrogens is replaced by a 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazol-4-yl]formyl group.


benoxaprofen

A monocarboxylic acid that is propionic acid substituted at position 2 by a 2-(4-chlorophenyl)-1,3-benzoxazol-5-yl group. It was used as a non-steroidal anti-inflammatory drug until 1982 when it was withdrawn from the market due to adverse side-effects including liver necrosis, photosensitivity, and carcinogenicity in animals.


flucloxacillin

A penicillin compound having a 6beta-[3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamido] side-chain.


cobimetinib

A member of the class of N-acylazetidines obtained by selective formal condensation of the carboxy group of 3,4-difluoro-2-(2-fluoro-4-iodoanilino)benzoic acid with the secondary amino group from the azetidine ring of 3-[(2S)-piperidin-2-yl]azetidin-3-ol. An inhibitor of mitogen-activated protein kinase that is used (as its fumarate salt) in combination with vemurafenib for the treatment of patients with unresectable or metastatic melanoma.


ticarcillin

A penicillin compound having a 6beta-[(2R)-2-carboxy-2-thiophen-3-ylacetyl]amino side-group.


name: S22A8_MOUSE Organic anion transporter 3 (sprot)

description: An organic anion transporter 3 that is encoded in the genome of mouse.


methicillin

A penicillin that is 6-aminopenicillanic acid in which one of the amino hydrogens is replaced by a 2,6-dimethoxybenzoyl group.


cefmetazole

A second-generation cephalosporin antibiotic having N(1)-methyltetrazol-5-ylthiomethyl, {[(cyanomethyl)sulfanyl]acetyl}amino and methoxy side-groups at positions 3, 7beta and 7alpha respectively of the parent cephem bicyclic structure.


cefoxitin

A semisynthetic cephamycin antibiotic which, in addition to the methoxy group at the 7alpha position, has 2-thienylacetamido and carbamoyloxymethyl side-groups. It is resistant to beta-lactamase.


phenoxymethylpenicillin

A penicillin compound having a 6beta-(phenoxyacetyl)amino side-chain.


oxacillin

A penicillin antibiotic carrying a 5-methyl-3-phenylisoxazole-4-carboxamide group at position 6beta.


nafcillin

A penicillin in which the substituent at position 6 of the penam ring is a (2-ethoxy-1-naphthoyl)amino group.


cefadroxil

A cephalosporin bearing methyl and  (2R)-2-amino-2-(4-hydroxyphenyl)acetamido groups at positions 3 and 7, respectively, of the cephem skeleton.


name: S22A8_RAT Organic anion transporter 3 (sprot)

description: An organic anion transporter 3 that is encoded in the genome of rat.


name: S22A8_HUMAN Organic anion transporter 3 (sprot)

description: An organic anion transporter 3 that is encoded in the genome of human.


name: PGAM1_HUMAN Phosphoglycerate mutase 1 (sprot)

description: A phosphoglycerate mutase 1 that is encoded in the genome of human.


name: [Mpa1, D-Tyr(Et)2, Gly(But)3, Gly(But)7]OT


A hydroxycoumarin that is coumarin in which the hydrogen at position 4 is replaced by a hydroxy group.


ISOSCOPOLETIN

A hydroxycoumarin that is esculetin in which the hydroxy group at position 7 is replaced by a methoxy group. It is the major primary metabolite of scoparone.


rifaximin

A semisynthetic member of the class of rifamycins and non-systemic gastrointestinal site-specific broad spectrum antibiotic. Used in the treatment of traveller's diarrhoea, hepatic encephalopathy and irritable bowel syndrome.


DOCEBENONE

A member of the class of benzoquinones that is p-benzoquinone in which the hydrogens are substituted by three methyl groups and a 12-hydroxydodeca-5,10-diyn-1-yl group.


PATUPILONE

An epithilone that is epithilone D in which the double bond in the macrocyclic ring has been oxidised to the corresponding epoxide (the S,S stereoisomer).


dibunate

A naphthalenemonosulfonate obtained by the deprotonation of the sulfonic acid group of dibunic acid.


carubicin

A toxic anthracycline antibiotic that is produced by Actinomadura carminata and also has potent antineoplastic activity.


metacycline

A tetracycline that is the 6-methylene analogue of oxytetracycline, obtained by formal dehydration at position 6.


desoximetasone

Dexamethasone in which the hydroxy group at the 17alpha position is substituted by hydrogen. A synthetic corticosteroid with glucocorticoid activity, it is used as an anti-inflammatory and anti-pruritic in the treatment of various skin disorders, including skin allergies and psoriasis.


demecolcine

A secondary amino compound that is (S)-colchicine in which the N-acetyl group is replaced by an N-methyl group. Isolable from the autumn crocus, Colchicum autumnale, it is less toxic than colchicine and is used as an antineoplastic.


name: 2-[1-Phenyl-meth-(Z)-ylidene]-malonic Acid Monoethyl Ester


lipoic acid

The (R)-enantiomer of lipoic acid. A vitamin-like, C8 thia fatty acid with anti-oxidant properties.


methylprednisolone

The 6alpha-stereoisomer of  6-methylprednisolone.


name: 3,5-dimethylbenzoic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester


cefaloridine

A cephalosporin compound having pyridinium-1-ylmethyl and 2-thienylacetamido side-groups. A first-generation semisynthetic derivative of cephalosporin C.


ALBU_RAT Albumin (sprot)

An albumin that is encoded in the genome of rat.


name: SL9A1_RAT Sodium/hydrogen exchanger 1 (sprot)

description: A sodium/hydrogen exchanger 1 that is encoded in the genome of rat.


DIDEMETHYLCURCUMIN

A beta-diketone that is curcumin in which the two methoxy groups have been replaced by hydroxy groups. It is a metabolite of curcumin.


name: 2-(4-(2-Trifluoromethylphenyl)piperidine-1-yl)-6-methylpyrimidine-4-carboxylic acid methyl ester


A isothiocyanate that is hexane in which two of the terminal methyl hydrogens at positions 1 and 6 have been replaced by isothiocyanato and methylsulfanyl groups.


name: HMDH_PIG 3-hydroxy-3-methylglutaryl-coenzyme A reductase (sprot)


An organic heterotetracyclic compound that is 1H-indole which is ortho-fused to a 2H-1-benzothiopyran group at positions 2-3. It is an inhibitor of 15-lipoxygenase that limits atherosclerotic lesion development in rabbits.


thioguanine

A 2-aminopurine that is the 6-thiono derivative of 2-amino-1,9-dihydro-6H-purine. Incorporates into DNA and inhibits synthesis. Used in the treatment of leukaemia.


An organic sulfide that consists of two 4-hydroxybenzyl groups covalently bound to a central sulfur atom. It is isolated from Gastrodia elata and Pleuropterus ciliinervis and exhibits neoroprotective activity.


name: (3-Thiophen-3-yl-2,4-dihydro-indeno[1,2-c]pyrazol-5-yl)-carbamic acid ethyl ester


picrotoxinin

A picrotoxane sesquiterpenoid that is 3a,4,5,6,7,7a-hexahydro-1H-indene-3,7-dicarboxylic acid which is substituted at positions 3a, 6, and 7a by methyl, isopropenyl, and hydroxy groups, respectively; in which the double bond at position 2-3 has been epoxidised; and in which the carboxy groups at positions 3 and 7 have undergone gamma-lactone formation by O-alkylation to positions 4 and 5, respectively. A component of picrotoxin.


name: GLRA2_RAT Glycine receptor subunit alpha-2 (sprot)

description: A protein that is a translation product of the Glra2 gene in rat.


picrotin

An organic heteropentacyclic compound that is picrotoxinin in which the olefinic double bond has undergone addition of water to give the corresponding tertiary alcohol. It is the less toxic component of picrotoxin, lacking GABA activity.


UDP-glucuronic acid

A UDP-sugar having alpha-D-glucuronic acid as the sugar component.


UDP-galactose

A UDP-D-galactose in which the anomeric centre of the galactose moiety has alpha-configuration.


givinostat

A member of the class of naphthalenes that is naphthalene substituted by ({[4-(hydroxycarbamoyl)phenyl]carbamoyl}oxy)methyl and (diethylamino)methyl groups at positions 2 and 6, respectively. It is a histone deacetylase inhibitor indicated for individuals diagnosed with Duchenne muscular dystrophy.


pracinostat

A hydroxamic acid that is N-hydroxyacrylamide which is substituted at position 3 by a 2-butyl-1-[2-(diethylamino)ethyl]-1H-benzimidazol-5-yl group (the E isomer). An orally available pan-histone deacetylase inhibitor with demonstrated activity in the treatment of advanced solid tumours.


name: 6-{[3-(2-Chloro-4-fluorophenylcarbamoyl)pyrazole-1-carbonyl]-amino}-hexanoic acid ethyl ester


INDY

A member of the class of benzothiazoles that is 2,3-dihydro-1,3-benzothiazole substituted by 2-oxopropylidene, ethyl, and hydroxy groups at positions 2, 3 and 5, respectively. It is an ATP-competitive inhibitor of Dyrk1A and Dyrk1B (IC50 of 0.24 muM and 0.23 muM, respectively).


A pyrimidone that is uracil with a methyl group at position 6.


A pyrimidone that is uracil with methyl group substituents at positions 1 and 3.


name: Benzenepropanoic acid, 2,4-dihydroxy-, ethyl ester


name: 2-(3 Chlorophenylamino)-4-trifluoromethylpyrimidine-5-carboxylic acid benzylamide


BAUHINOXEPIN I

A dibenzooxepine that is 10,11-dihydrodibenzo[b,f]oxepine-1,4-dione substituted by a hydroxy, a methoxy and a methyl group at positions 8, 2 and 3 respectively. It is isolated from the root extract of Bauhinia purpurea and exhibits antimalarial, antimycobacterial, antifungal, anti-inflammatory and cytotoxic activities.


BAUHINOXEPIN F

A dibenzooxepine that is  10,11-dihydrodibenzo[b,f]oxepine substituted by methoxy groups at positions 6 and 9, methyl group at position 7 and hydroxy groups at positions 1 and 8 respectively. It is isolated from the root extract of Bauhinia purpurea and exhibits antimalarial, antimycobacterial, antifungal, anti-inflammatory and cytotoxic activities.


emtricitabine

An organofluorine compound  that is 5-fluorocytosine substituted at the 1 position by a 2-(hydroxymethyl)-1,3-oxathiolan-5-yl group (2R,5S configuration). It is used in combination therapy for the treatment of HIV-1 infection.


lamivudine

A monothioacetal that consists of cytosine having a (2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl moiety attached at position 1. An inhibitor of HIV-1 reverse transcriptase, it is used as an antiviral in the treatment of AIDS and hepatitis B.


name: MDM2_CANLF E3 ubiquitin-protein ligase Mdm2 (sprot)


name: MDM2_MOUSE E3 ubiquitin-protein ligase Mdm2 (sprot)

description: An E3 ubiquitin-protein ligase Mdm2 that is encoded in the genome of mouse.


sucrose

A glycosyl glycoside formed by glucose and fructose units joined by an acetal oxygen bridge from hemiacetal of glucose to the hemiketal of the fructose.


name: Acetic acid, 2-chloro-, 4-formyl-2-methoxyphenyl ester


glyinflanin H

A chromenol that is 2,2-dimethyl-2H-chromen-5-ol substituted by a 6-hydroxy-1-benzofuran-2-yl group at position 6.


name: 3-[(Z)-4-trifluoromethoxy-phenylimino]-2-thia-4-aza-spiro[5.5]undecane-4-carbodithioic acid methyl ester


name: N-[4(5,7-Dinitro-3-phenyl-quinoxalin-2-ylamino)-benzoyl]glutamic acid diethyl ester


CAN_YEAST Carbonic anhydrase (sprot)

A protein that is a translation product of the NCE103 gene in yeast.


name: TNF11_MOUSE Tumor necrosis factor ligand superfamily member 11 (sprot)

description: A tumor necrosis factor ligand superfamily member 11 that is encoded in the genome of mouse.


name: PCSK6_RAT Proprotein convertase subtilisin/kexin type 6 (sprot)

description: A proprotein convertase subtilisin/kexin type 6 that is encoded in the genome of rat.


name: PCSK4_HUMAN Proprotein convertase subtilisin/kexin type 4 (sprot)

description: A proprotein convertase subtilisin/kexin type 4 that is encoded in the genome of human.


name: PCSK7_HUMAN Proprotein convertase subtilisin/kexin type 7 (sprot)

description: A proprotein convertase subtilisin/kexin type 7 that is encoded in the genome of human.


name: Octanedioic acid hydroxyamide [4-(3-nitro-phenyl)thiazol-2-yl]amide


name: Octanedioic acid [2''-(2-amino-3-phenylpropionylamino)-biphenyl-4-yl]amide hydroxyamide


aceclofenac

A monocarboxylic acid that is the carboxymethyl ester of diclofenac. A non-steroidal anti-inflammatory drug related to diclofenac, it is used in the management of osteoarthritis, rheumatoid arthritis, and ankylosing spondylitis.


name: KCNN3_RAT 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 rat.


cordysinin B

A member of the class of adenosines that is adenosine in which the hydroxy group at position 2' is replaced by a methoxy group. It has been isolated from the mycelia of Cordyceps sinensis.


name: MP2K1_MOUSE Dual specificity mitogen-activated protein kinase kinase 1 (sprot)

description: A dual specificity mitogen-activated protein kinase kinase 1 that is encoded in the genome of mouse.


name: EMBA_MYCTU Probable arabinosyltransferase A (sprot)

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


A dibenzoazepine that is 5,7-dihydro-6H-dibenzo[b,d]azepin-6-one which is substituted at the 7 pro-S position by the C-terminal carboxamide nitrogen of N(2)-[(2S)-2-(3,5-difluorophenyl)-2-hydroxyacetyl]-L-alaninamide. It is a potent, cell permeable and selective gamma-secretase inhibitor. It has been tested as a possible treatment for Alzheimer's disease and shows promise for its potential to counteract severe hearing loss.


name: (2S,3R)-1-(3-chloro-4-cyano-2-methyl-phenylsulfamoyl)-3-hydroxy-pyrrolidine-2-carboxylic acid methyl ester


name: 2-(4-Cyclohexylthiosemicarbazono)methyl-benzoic acid methyl ester


name: 4-(3-Hydroxy-phenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic acid 2-(2-mercapto-ethoxy)-ethyl ester


name: 4-(3-Hydroxy-phenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic acid 2-(2-hydroxy-ethoxy)-ethyl ester


name: 2,6-Dihydroxy-3'',5''-dimethyl-biphenyl-4-carboxylic acid pentyl ester


name: 2,6-Dihydroxy-3'',5''-dimethyl-biphenyl-4-carboxylic acid butyl ester


name: 2,6-Dihydroxy-3'',5''-dimethyl-biphenyl-4-carboxylic acid methyl ester


name: 2-Hydroxy-6-methoxy-3'',5''-dimethyl-biphenyl-4-carboxylic acid pentyl ester


name: 2-Hydroxy-6-methoxy-3'',5''-dimethyl-biphenyl-4-carboxylic acid methyl ester


name: 2,6-Dihydroxy-biphenyl-4-carboxylic acid pentyl ester


name: MOGT2_MOUSE 2-acylglycerol O-acyltransferase 2 (sprot)

description: A 2-acylglycerol O-acyltransferase 2 that is encoded in the genome of mouse.


name: IF4E_RABIT Eukaryotic translation initiation factor 4E (sprot)

description: A eukaryotic translation initiation factor 4E that is encoded in the genome of rabbit.


name: KS6A3_MOUSE Ribosomal protein S6 kinase alpha-3 (sprot)

description: A ribosomal protein S6 kinase alpha-3 that is encoded in the genome of mouse.


name: DHB3_RAT 17-beta-hydroxysteroid dehydrogenase type 3 (sprot)

description: A 17-beta-hydroxysteroid dehydrogenase type 3 that is encoded in the genome of rat.


ANDROSTERONE

An androstanoid that is 5alpha-androstane having a hydroxy substituent at the 3alpha-position and an oxo group at the 17-position. It is a metabolite of dehydroepiandrosterone .


name: SCNNA_MOUSE Amiloride-sensitive sodium channel subunit alpha (sprot)

description: An amiloride-sensitive sodium channel subunit alpha that is encoded in the genome of mouse.


The E (trans) stereoisomer of 4-hydroxynon-2-enal; it is the primary alpha,beta-unsaturated hydroxyalkenal produced by lipid peroxidation in cells.


name: [4''-(5-Amino-4-cyanopyrazol-1-yl)-benzoylamino]-acetic acid methyl ester


name: 4-amino-4-methyl-pent-2-ynthioic acid S-methyl ester


name: PTP1_YEAST Tyrosine-protein phosphatase 1 (sprot)

description: A protein that is a translation product of the PTP1 gene in yeast.


name: HISX_BRUSU Histidinol dehydrogenase (sprot)

description: A histidinol dehydrogenase that is encoded in the genome of Brucella suis 1330.


An organic disulfide obtained by oxidative dimerisation of 1-sulfanylnaphthalen-2-ol.


PHOSPHINOTHRICIN

A 2-amino-4-[hydroxy(methyl)phosphoryl]butanoic acid that has S configuration at position 2. A glutamine synthetase inhibitor, it is used (generally as the corresponding ammonium or sodium salts, known as glufosinate-P-ammonium and glufosinate-P-sodium, respectively) as a herbicide to control annual weeds and grasses.


GSK805 is an orally active and CNS penetrant RORgammat inhibitor. GSK805 inhibits RORgamma and Th17 cells differentiation. GSK805 inhibits the function of Th17 cells. GSK805 can be used for the research of immunity.


name: SCN5A_RAT Sodium channel protein type 5 subunit alpha (sprot)

description: A sodium channel protein type 5 subunit alpha that is encoded in the genome of rat.


name: SCN9A_RAT Sodium channel protein type 9 subunit alpha (sprot)

description: A sodium channel protein type 9 subunit alpha that is encoded in the genome of rat.


name: 3-[5-(2-Amino-phenylcarbamoyl)-pyridin-2-yl]-3,8-diaza-bicyclo[3.2.1]octane-8-carboxylic acid tert-butyl ester


name: 3-[5-(2-Amino-phenylcarbamoyl)-pyridin-2-yl]-3,8-diaza-bicyclo[3.2.1]octane-8-carboxylic acid benzyl ester


name: Icosa-5,8,11,14-tetraenoic acid tetrahydro-furan-3-ylmethyl ester


name: Icosa-5,8,11,14-tetraenoic acid tetrahydro-furan-2-ylmethyl ester


name: (4''-Cyano-3''-trifluoromethyl-biphenyl-2-yloxy)-acetic acid methyl ester


name: GBA2_MOUSE Non-lysosomal glucosylceramidase (sprot)

description: A non-lysosomal glucosylceramidase that is encoded in the genome of mouse.


name: CEGT_MOUSE Ceramide glucosyltransferase (sprot)

description: A ceramide glucosyltransferase that is encoded in the genome of mouse.


name: AAPK1_RAT 5'-AMP-activated protein kinase catalytic subunit alpha-1 (sprot)

description: A 5'-AMP-activated protein kinase catalytic subunit alpha-1 that is encoded in the genome of rat.


A hydroxyisoflavone that is daidzein bearing an additional hydroxy substituent at position 6.


name: BLKPC_KLEPN Carbapenem-hydrolyzing beta-lactamase KPC (sprot)

description: A protein that is a translation product of any of the plasmid-encoded copies of the blaKPC-2 gene in Klebsiella pneumoniae.


name: (S)-alpha-[[[4-bromo-5-[(2-chlorobenzoyl)amino]-1H-pyrazol-3-yl]carbonyl]amino]benzeneacetic acid methyl ester


name: SIGL7_HUMAN Sialic acid-binding Ig-like lectin 7 (sprot)

description: A sialic acid-binding Ig-like lectin 7 that is encoded in the genome of human.


name: 5-[2-(4-Adamantan-1-yl-phenoxy)acetylamino]-nicotinic acid methyl ester


name: 3-[2-(4-Adamant-1-yl-phenoxy)-acetylamino]-benzoic acid methyl ester


name: 2-[2-(4-Adamantan-1-yl-phenoxy)-acetylamino]-isonicotinic acid methyl ester


A member of the class of indazoles that is 1H-indazole substituted by a [6-(methylamino)-3-nitropyridin-2-yl]amino group at position 5. It is an inhibitor of heat shock factor 1 (IC50 = 1.2muM) and suppresses tumour growth in mouse xenograft models.


name: LUXP_VIBHA Autoinducer 2-binding periplasmic protein LuxP (sprot)


L-homocysteine

A sulfur-containing amino acid consisting of a glycine core with a 2-mercaptoethyl side-chain.


name: EPHB2_MOUSE Ephrin type-B receptor 2 (sprot)

description: An ephrin type-B receptor 2 that is encoded in the genome of mouse.


name: Pyrrolidine-1-carboxylic acid 4-(3,5-dichloropyridin-2-yloxy)-phenyl ester


name: (4-Chloro-phenyl)-methyl-carbamic acid 4-(5-trifluoromethylpyridin-2-yloxy)-phenyl ester


name: (3-Chloro-phenyl)-methyl-carbamic acid 4-(5-trifluoromethylpyridin-2-yloxy)-phenyl ester


name: Morpholine-4-carboxylic acid 4-(3,5-dichloro-pyridin-2-yloxy)-phenyl ester


name: Methyl-p-tolyl-carbamic acid 4-(5-trifluoromethyl-pyridin-2-yloxy)-phenyl ester


name: 4-Hydroxy-piperidine-1-carboxylic acid 4-(5-trifluoromethyl-pyridin-2-yloxy)-phenyl ester


name: Methyl-o-tolyl-carbamic acid 4-(trifluoromethylpyridin-2-yloxy)-phenyl ester


name: 4-Benzoyl-piperidine-1-carboxylic acid 4-(5-trifluoromethylpyridin-2-yloxy)-phenyl ester


name: (4-Methoxy-phenyl)-methyl-carbamic acid 4-(5-trifluoromethylpyridin-2-yloxy)-phenyl ester


name: 2,6-Dimethyl-morpholine-4-carboxylic acid 4-(5-trifluoromethylpyridin-2-yloxy)-phenyl ester


name: Methyl-phenyl-carbamic acid 4-(3,5-dichloro-pyridin-2-yloxy)-phenyl ester


name: (2-Methoxy-phenyl)-methyl-carbamic acid 4-(5-trifluoromethylpyridin-2-yloxy)-phenyl ester


name: Methyl-phenyl-carbamic acid 4-(5-chloropyridin-2-yloxy)-phenyl ester


name: 4-Benzyl-piperidine-1-carboxylic acid 4-(5-trifluoromethyl-pyridin-2-yloxy)-phenyl Ester


name: 3,4-dihydro-1H-isoquinoline-2-carboxylic acid 4-(5-trifluoromethylpyridin-2-yloxy)-phenyl ester


name: 4-Methyl-piperidine-1-carboxylic acid 4-(5-trifluoromethylpyridin-2-yloxy)-phenyl ester


name: Benzyl-methyl-carbamic acid 4-(5-trifluoromethylpyridin-2-yloxy)-phenyl ester


name: (2-Chloro-phenyl)-methyl-carbamic acid 4-(5-trifluoromethylpyridin-2-yloxy)-phenyl ester


name: 4-Hydroxymethyl-piperidine-1-carboxylic acid 4-(5-trifluoromethylpyridin-2-yloxy)-phenyl ester


name: Piperidine-1-carboxylic acid 4-(5-trifluoromethylpyridin-2-yloxy)-phenyl ester


name: 1,3-Dihydro-isoindole-2-carboxylic Acid 4-(5-trifluoromethyl-pyridin-2-yloxy)-phenyl Ester


name: 3-Methyl-piperidine-1-carboxylic acid 4-(5-trifluoromethylpyridin-2-yloxy)-phenyl ester


name: Methyl-phenyl-carbamic acid 4-(3,5-dichloropyridin-4-yloxy)-phenyl ester


name: Pyrrolidine-1-carboxylic acid 4-(5-trifluoromethylpyridin-2-yloxy)-phenyl ester


name: Morpholine-4-carboxylic acid 4-(5-trifluoromethylpyridin-2-yloxy)-phenyl ester


name: Methyl-m-tolyl-carbamic acid 4-(5-trifluoromethylpyridin-2-yloxy)-phenyl ester


name: Methyl-phenyl-carbamic acid 4-(5-trifluoromethylpyridin-2-yloxy)-phenyl ester


name: 2-amino-7-hydroxy-4-[4-(4-methyl-benzyloxy)-phenyl]-4H-chromene-3-carboxylic acid methyl ester


name: SNAT_SHEEP Serotonin N-acetyltransferase (sprot)

description: A protein that is a translation product of the AANAT gene in sheep.


compound 1 [PMID: 17935984]

A member of the class of barbiturates that is barbituric acid in which the hydrogens at position 5 are replaced by 2-ethoxyethyl and 4-(4-fluorophenoxy)phenoxy groups. It is a potent and selective inhibitor of matrix MMP-13 (metalloproteinase-13, collagenase 3).


name: (+)-5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4,5-dihydro-1H-pyrazole-3-carboxylic acid morpholin-4-ylamide bisulphate salt


name: FADS1_HUMAN Acyl-CoA (8-3)-desaturase (sprot)

description: An acyl-CoA (8-3)-desaturase that is encoded in the genome of human.


name: 8-Ethyl-9-oxo-8,9-dihydro-thiazolo[5,4-f]quinazoline-2-carboximidic acid isopropyl ester


name: 8-Ethyl-9-oxo-8,9-dihydro-thiazolo[5,4-f]quinazoline-2-carboximidic acid butyl ester


name: 8-Ethyl-9-oxo-8,9-dihydro-thiazolo[5,4-f]quinazoline-2-carboximidic acid benzyl ester


name: 8-Isopropyl-9-oxo-8,9-dihydro-thiazolo[5,4-f]quinazoline-2-carboximidic acid ethyl ester


name: 8-Isopropyl-9-oxo-8,9-dihydro-thiazolo[5,4-f]quinazoline-2-carboximidic acid isopropyl ester


name: 8-Isopropyl-9-oxo-8,9-dihydro-thiazolo[5,4-f]quinazoline-2-carboximidic acid butyl ester


name: 8-Isopropyl-9-oxo-8,9-dihydro-thiazolo[5,4-f]quinazoline-2-carboximidic acid benzyl ester


name: NHAA_ECOLI Na(+)/H(+) antiporter NhaA (sprot)

description: A Na(+)/H(+) antiporter NhaA that is encoded in the genome of Escherichia coli K-12.


A scalarane sesterterpenoid  that is 12-O-deacetyl-12-epi-19-deoxy-scalarin substituted by an additional hydroxy group at position 21. It has been isolated from the sponge, Hyattella species.


The 12-epimer of scalarin, a metabolite of marine sponges of the genus Spongia.


name: AA3R_CANLF Adenosine receptor A3 (sprot)


A secondary carboxamide resulting from the formal condensation of the carboxy group of 5-(4-chloro-3-methylphenyl)-1-(4-methylbenzyl)-1H-pyrazole-3-carboxylic acid with the amino group of (1S,2S,4R)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-amine. A potent and selective cannabinoid receptor type 2 (CB2 receptor) inverse agonist (Ki = 0.6 nM).


name: TRPV4_MOUSE Transient receptor potential cation channel subfamily V member 4 (sprot)

description: A transient receptor potential cation channel TRPV4 that is encoded in the genome of mouse.


name: TRPV4_RAT Transient receptor potential cation channel subfamily V member 4 (sprot)

description: A transient receptor potential cation channel TRPV4 that is encoded in the genome of rat.


name: 2-[Methyl(2,5-dioxo-3-methyl-3-pyrroline-1-yl)amino]-4-(pentafluoroethyl)-5-pyrimidinecarboxylic acid ethyl ester


name: 2-(2,5-Dioxo-3-methyl-3-pyrroline-1-ylamino)-4-(pentafluoroethyl)-5-pyrimidinecarboxylic acid ethyl ester


name: MGAT3_HUMAN Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase (sprot)

description: A beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase that is encoded in the genome of human.


name: SMS1_HUMAN Phosphatidylcholine:ceramide cholinephosphotransferase 1 (sprot)

description: A phosphatidylcholine:ceramide cholinephosphotransferase 1 that is encoded in the genome of human.


A lactam that is 2,3-dihydro-1,5-benzothiazepin-4(5H)-one in which positions 2 and 3 are substituted by 4-methoxyphenyl and acetoxy, respectively, while the hydrogen attached to the nitrogen is substituted by a 2-(dimethylamino)ethyl group.


name: 4-(2-Chloro-10,11-dihydro-dibenzo[a,d]cyclohepten-5-ylidene)-piperidine-1-carboxylic acid ethyl ester(Loratadine)


NEUR1_HUMAN Sialidase-1 (sprot)

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


(R)-sulforaphane

A sulforaphane in which the sulfinyl group has R configuration. Naturally occurring compound found in brocolli that acts as a potent inducer of phase II detoxification enzymes.


TKT_HUMAN Transketolase (sprot)

A transketolase that is encoded in the genome of human.


name: SCN8A_MOUSE Sodium channel protein type 8 subunit alpha (sprot)

description: A sodium channel protein type 8 subunit alpha that is encoded in the genome of mouse.


name: SCN4A_MOUSE Sodium channel protein type 4 subunit alpha (sprot)

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


name: SCN1A_MOUSE Sodium channel protein type 1 subunit alpha (sprot)

description: A sodium channel protein type 1 subunit alpha that is encoded in the genome of mouse.


name: BCAT2_HUMAN Branched-chain-amino-acid aminotransferase, mitochondrial (sprot)

description: A branched-chain-amino-acid aminotransferase, mitochondrial that is encoded in the genome of human.


TRICARBALLYLIC ACID

A tricarboxylic acid that is glutaric acid in which one of the beta-hydrogens is substituted by a carboxy group.


PRLR_HUMAN Prolactin receptor (sprot)

A prolactin receptor that is encoded in the genome of human.


name: CNOT7_HUMAN CCR4-NOT transcription complex subunit 7 (sprot)

description: A CCR4-NOT transcription complex subunit 7 that is encoded in the genome of human.


name: (R)-{4-[{2-[3-Amino-4-(2,4,5-trifluorophenyl)butyryl]-3,4-dihydro-2H-pyrazole-3-carbonyl}amino]phenoxy}-(R)-isopropyl acetic acidethyl ester HCl


name: (R)-{4-[{2-[3-Amino-4-(2,4,5-trifluorophenyl)butyryl]-3,4-dihydro-2H-pyrazole-3-carbonyl}amino]phenoxy}-(S)-isopropyl acetic acid ethyl ester HCl


name: (R)-{2-[{2-[3-Amino-4-(2,4,5-trifluorophenyl)butyryl]-3,4-dihydro-2H-pyrazole-3-carbonyl}amino]phenoxy}acetic acid ethyl ester HCl


name: (R)-{3-[{2-[3-Amino-4-(2,4,5-trifluorophenyl)butyryl]-3,4-dihydro-2H-pyrazole-3-carbonyl}amino]phenoxy}acetic acid ethyl ester HCl


name: (R)-{4-[{2-[3-Amino-4-(2,4,5-trifluorophenyl)butyryl]-3,4-dihydro-2H-pyrazole-3-carbonyl}amino]phenoxy}acetic acid ethyl ester HCl


name: (R)-2-[3-Amino-4-(2,4,5-trifluorophenyl)butyryl]-3,4-dihydro-2H-pyrazole-3-carboxylic acid(4-sulfamoyl phenyl)amide HCl


name: (R)-{3-[({2-[3-Amino-4-(2,4,5-trifluorophenyl)butyryl]-3,4-dihydro-2H-pyrazole-3-carbonyl}amino)methyl]phenoxy}acetic acid ethyl ester HCl


name: (R)-{4-[({2-[3-Amino-4-(2,4,5-trifluorophenyl)butyryl]-3,4-dihydro-2H-pyrazole-3-carbonyl}amino)methyl]phenoxy}acetic acid ethyl ester HCl


name: (R)-2-[3-Amino-4-(2,4,5-trifluorophenyl)butyryl]-3,4-dihydro-2H-pyrazole-3-carboxylic acid4-sulfamoyl benzyl amide HCl


name: (R)-2-[3-Amino-4-(2,4,5-trifluorophenyl)butyryl]-3,4-dihydro-2H-pyrazole-3-carboxylic acid 4-aminobenzyl amide HCl


name: (R)-4-({2-[3-Amino-4-(2,4,5-trifluorophenyl)butyryl]-3,4-dihydro-2H-pyrazole-3-carbonyl}amino)benzoic acid ethyl ester HCl


name: (R)-2-[3-Amino-4-(2,4,5-trifluorophenyl)butyryl]-3,4-dihydro-2H-pyrazole-3-carboxylic acid phenyl amideHCl


name: (R)-4-[({2-[3-Amino-4-(2,4,5-trifluorophenyl)butyryl]-3,4-dihydro-2H-pyrazole-3-carbonyl}amino)methyl]benzoic acid methyl ester HCl


name: (R)-2-[3-Amino-4-(2,4,5-trifluorophenyl)butyryl]-3,4-dihydro-2H-pyrazole-3-carboxylic acid benzylamide HCl


name: (R)-2-[3-Amino-4-(2,4,5-trifluorophenyl)butyryl]-3,4-dihydro-2H-pyrazole-3-carboxylic acid amide HCl


name: (R)-2-[3-Amino-4-(2,4,5-trifluorophenyl)butyryl]-3,4-dihydro-2H-pyrazole-3-carboxylic acid 4-methoxycarbonylmethyl phenyl ester HCl


name: (R)-2-[3-Amino-4-(2,4,5-trifluorophenyl)butyryl]-3,4-dihydro-2H-pyrazole-3-carboxylic acid 4-ethoxycarbonylphenyl ester HCl


name: (R)-2-[3-Amino-4-(2,4,5-trifluorophenyl)butyryl]-3,4-dihydro-2H-pyrazole-3-carboxylic acid phenyl ester hydrochloride


name: (R)-2-[3-Amino-4-(2,4,5-trifluorophenyl)butyryl]-3,4-dihydro-2H-pyrazole-3-carboxylic acid 4-methoxycarbonylbenzyl ester HCl


name: (R)-2-[3-Amino-4-(2,4,5-trifluorophenyl)butyryl]-3,4-dihydro-2H-pyrazole-3-carboxylic acid benzyl esterHCl


(R)-talarozole

An N-{4-[2-ethyl-1-(1H-1,2,4-triazol-1-yl)butyl]phenyl}-1,3-benzothiazol-2-amine that is the (R)-enantiomer of talarozole. The racemate is used for the treatment of keratinization disorders, psoriasis and acne.


name: ACHA7_BOVIN Neuronal acetylcholine receptor subunit alpha-7 (sprot)


aloin B

A C-glycosyl compound that is beta-D-glucopyranose in which the anomeric hydroxy group is replaced by a 4,5-dihydroxy-2-(hydroxymethyl)-10-oxo-9,10-dihydroanthracen-9-yl moiety (the 9R diastereoisomer).


aloin

A diastereoisomeric mixture of aloin A (barbaloin) and aloin B (isobarbaloin), which have similar properties. It is a bitter-tasting, yellow-brown colored compound found in the exudate of at least 68 Aloe species at levels of up to 6.6% of leaf dry weight (making between 3% and 35% of the total exudate), and in another 17 species at indeterminate levels. It is used as a stimulant-laxative, treating constipation by inducing bowel movements.


name: ENASE_HUMAN Cytosolic endo-beta-N-acetylglucosaminidase (sprot)

description: A cytosolic endo-beta-N-acetylglucosaminidase that is encoded in the genome of human.


name: [((R)-4-Hexadecanoyl-3-hydroxy-5-oxo-2,5-dihydro-furan-2-ylmethoxycarbonylimino)-methylene]-carbamic acid ethyl ester


name: COX2_HUMAN Cytochrome c oxidase subunit 2 (sprot)

description: A cytochrome c oxidase subunit 2 that is encoded in the genome of human.


name: COX1_SHEEP Cytochrome c oxidase subunit 1 (sprot)

description: A cytochrome c oxidase subunit 1 that is encoded in the genome of sheep.


name: AMY1_HORVU Alpha-amylase type A isozyme (sprot)


name: PFKA_TRYBB ATP-dependent 6-phosphofructokinase (sprot)


name: GGT1_HUMAN Glutathione hydrolase 1 proenzyme (sprot)

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


name: KCNQ4_HUMAN Potassium voltage-gated channel subfamily KQT member 4 (sprot)

description: A voltage-gated potassium channel subunit KCNQ4 that is encoded in the genome of human.


name: KCNQ4_RAT Potassium voltage-gated channel subfamily KQT member 4 (Fragment) (sprot)


name: Sulfamic Acid 4-{3-[(4-cyano-phenyl)-[1,2,4]triazol-4-yl-amino]-propylsulfanyl}-phenyl Ester


name: OAT_HUMAN Ornithine aminotransferase, mitochondrial (sprot)

description: An ornithine aminotransferase, mitochondrial that is encoded in the genome of human.


name: GNRHR_MACMU Gonadotropin-releasing hormone receptor (Fragment) (sprot)


name: trans-4-Hydroxy-1-(toluene-4-sulfonyl)-pyrrolidine-2-carboxylic acid methyl ester


name: (S)-2-(Toluene-4-sulfonyl)-6,10-dioxa-2-aza-spiro[4.5]decane-3-carboxylic acid methyl ester


name: (S)-7-(Toluene-4-sulfonyl)-1,4-dioxa-7-aza-spiro[4.4]nonane-8-carboxylic acid methyl ester


name: trans-4-Hydroxy-1-methanesulfonyl-pyrrolidine-2-carboxylic acid methyl ester


name: trans-1-Benzenesulfonyl-4-hydroxy-pyrrolidine-2-carboxylic acid methyl ester


vorapaxar

A carbamate ester that is the ethyl ester of [(1R,3aR,4aR,6R,8aR,9S,9aS)-9-{(E)-2-[5-(3-fluorophenyl)pyridin-2-yl]ethynyl}-1-methyl-3-oxododecahydronaphtho[2,3-c]furan-6-yl]carbamic acid. A protease-activated receptor-1 antagonist used (as its sulfate salt) for the reduction of thrombotic cardiovascular events in patients with a history of myocardial infarction (MI) or with peripheral arterial disease. It has been shown to reduce the rate of a combined endpoint of cardiovascular death, MI, stroke and urgent coronary revascularisation.


NCAP_I33A0 Nucleoprotein (sprot)

A nucleoprotein (Influenza A virus) that is encoded in the genome of the H1N1 strain A/Wilson-Smith/1933.


A 5-hydroxylysine consisting of L-lysine having an (R)-hydroxy group at the 5-position.


name: GLN1B_SALTY Glutamine synthetase (sprot)


KTHY_HUMAN Thymidylate kinase (sprot)

A thymidylate kinase that is encoded in the genome of human.


name: Heptanoic acid (R)-1-heptanoyloxymethyl-2-thiophosphonooxy-ethyl ester


A 1,3-thiazole that is 4,5-dihydro-1,3-thiazole substituted by an amino group at position 2.


AMINOTHIAZOLE

A  primary amino compound that is 1,3-thiazole substituted by an amino group at position 2.


name: Carbamimidothioic acid, [2-(trifluoromethyl)phenyl]-, ethyl ester


name: 4-(2-Ethyl-isothioureido)-benzoic acid ethyl ester; hydriodide


An aminopyrimidine that is N-cyclohexyl-N-methylpyrimidin-2-amine in which the pyrimidine ring is substituted at position 4 by an imidazo[1,2-a]pyridin-3-yl group. It is an inhibitor of interleukin-1 receptor-associated kinase 4 (IRAK-4; EC 2.7.11.1).


name: FCGRN_HUMAN IgG receptor FcRn large subunit p51 (sprot)

description: An IgG receptor FcRn large subunit p51 that is encoded in the genome of human.


name: 2-Oxooxazolidine-3-carboxylic acid biphenyl-3-yl ester


name: Naphthalen-2-ylmethylcarbamic Acid 3''-Acetylbiphenyl-3-yl Ester


name: Biphenyl-3-ylcarbamic Acid Biphenyl-3-yl Ester


name: 4''-Phenyl-4-phenylbutylcarbamic Acid Biphenyl-3-yl Ester


name: 8-Phenyloctylcarbamic Acid Biphenyl-3-yl Ester


name: 6-Morpholinohexylcarbamic Acid Biphenyl-3-yl Ester


name: 6-Phenylhexylcarbamic Acid Biphenyl-3-yl Ester


name: 4-Phenylbutylcarbamic Acid Biphenyl-3-yl Ester


name: Naphthalen-2-ylmethylcarbamic Acid Biphenyl-3-yl Ester


name: Naphthalen-1-ylmethylcarbamic Acid Biphenyl-3-yl Ester


name: Indan-2-ylcarbamic Acid Biphenyl-3-yl Ester


name: Phenethylcarbamic Acid Biphenyl-3-yl Ester


name: Furan-2-ylmethylcarbamic Acid Biphenyl-3-yl Ester


name: Adamant-1-ylcarbamic Acid Biphenyl-3-yl Ester


name: (+/-)-Bicyclo[2.2.1]hept-2-ylcarbamic Acid Biphenyl-3-yl Ester


name: Cyclohexylmethylcarbamic Acid Biphenyl-3-yl Ester


name: Cyclopentylcarbamic Acid Biphenyl-3-yl Ester


name: Cyclobutylcarbamic Acid Biphenyl-3-yl Ester


name: n-Octylcarbamic Acid Biphenyl-3-yl Ester


name: n-Hexylcarbamic Acid Biphenyl-3-yl Ester


name: n-Butylcarbamic Acid Biphenyl-3-yl Ester


name: Isopropylcarbamic Acid Biphenyl-3-yl Ester


PELARGONIDIN

An anthocyanidin cation that is flavylium substituted by a hydroxy groups at positions 3, 5, 7 and 4'.


A 7-hydroxyisoflavone that is daidzein  substituted by a hydroxy group at position 3'.


OXDD_MOUSE D-aspartate oxidase (sprot)

A D-aspartate oxidase that is encoded in the genome of mouse.


5-aminonicotinic acid

An aminonicotinic acid in which the amino group is situated at position 5 of the pyridine ring.


3-AMINOBENZOIC ACID

An aminobenzoic acid carrying an amino group at position 3.


benzoic acid

A compound comprising a benzene ring core carrying a carboxylic acid substituent.


5-CHLOROSALICYLIC ACID

A monohydroxybenzoic acid that is 2-hydroxybenzoic acid (salicylic acid) in which the hydrogen at position 5 is replaced by chlorine.


2-amino-5-chlorobenzoic acid

A member of the class of chlorobenzoic acids that is benzoic acid in which the ring hydrogens at positions 2 and 5 are replaced by amino and chloro groups, respectively.