name: RGS19_HUMAN Regulator of G-protein signaling 19 (sprot)

description: A regulator of G-protein signaling 19 that is encoded in the genome of human.


name: RGS16_HUMAN Regulator of G-protein signaling 16 (sprot)

description: A regulator of G-protein signaling 16 that is encoded in the genome of human.


name: (2E)-3-(2-chloroanilino)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-3-keto-propionic acid ethyl ester


name: 5-(Naphthalen-2-yloxymethyl)-furan-2-carboxylic acid pyridin-2-ylmethyl ester


name: 1-[2-(3-Methoxyphenyl)-1,3-benzoxazole-6-carbonyl]isonipecotic acid methyl ester


name: DUS3_HUMAN Dual specificity protein phosphatase 3 (sprot)

description: A dual specificity protein phosphatase 3 that is encoded in the genome of human.


name: 3-[5-(4-Isopropyl-phenyl)-tetrazol-2-yl]-propionic acid methyl ester


name: MMP14_PONAB Matrix metalloproteinase-14 (sprot)


name: Piperidine-1-carboxylic acid 4-acetylamino-phenyl ester


name: [2-(1-p-Tolyl-1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanyl)-acetylamino]-acetic acid ethyl ester


leflunomide

A monocarboxylic acid amide obtained by formal condensation of the carboxy group of 5-methyl-1,2-oxazole-4-carboxylic acid with the anilino group of 4-(trifluoromethyl)aniline. The prodrug of teriflunomide.


name: 4-(5-Amino-benzooxazol-2-yl)-benzoic acid methyl ester


name: 2-(4-Acetyl-5-phenylamino-thiophene-2-carbonyl)-3-phenyl-acrylic acid ethyl ester


name: 3-Amino-7-isopropyl-7,8-dihydro-5H-pyrano[4,3-b]thieno[3,2-e]pyridine-2-carboxylic acid ethyl ester


name: 5-(3-Phenyl-ureido)-[1,2,3]thiadiazole-4-carboxylic acid isobutyl ester


name: Thiophene-2-carboxylic acid 1-[(furan-2-ylmethyl)-carbamoyl]-3-methyl-butyl ester


name: (6-Methyl-2-phenyl-imidazo[1,2-a]pyridin-3-yl)-carbamic acid methyl ester


name: 4-{4-[2-(5-Phenyl-tetrazol-2-yl)-acetylamino]-phenyl}-piperazine-1-carboxylic acid tert-butyl ester


aminosalicylic acid

An aminobenzoic acid that is salicylic acid substituted by an amino group at position 4.


metoclopramide

A member of the class of  benzamides resulting from the formal condensation of 4-amino-5-chloro-2-methoxybenzoic acid with the primary amino group of N,N-diethylethane-1,2-diamine.


name: benzoic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester


name: Benzoic acid (3-ketocoumaran-6-yl) ester


name: 4-[[[2-(4-methoxyphenyl)-3-oxo-1H-isoindol-4-yl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester


L-α-methyldopa

A derivative of L-tyrosine having a methyl group at the alpha-position and an additional hydroxy group at the 3-position on the phenyl ring.


N-benzoylanthranilic acid

An amidobenzoic acid comprising benzoic acid having a benzamido group at the 2-position.


name: 5-hydroxy-2-methyl-4-[1-piperidinyl(3-pyridinyl)methyl]-3-benzo[g]benzofurancarboxylic acid ethyl ester


name: IF4G1_HUMAN Eukaryotic translation initiation factor 4 gamma 1 (sprot)

description: A eukaryotic translation initiation factor 4 gamma 1 that is encoded in the genome of human.


dibucaine

A monocarboxylic acid amide that is the 2-(diethylamino)ethyl amide of 2-butoxyquinoline-4-carboxylic acid. One of the most potent and toxic of the long-acting local anesthetics, its parenteral use was restricted to spinal anesthesia. It is now generally only used (usually as the hydrochloride) in creams and ointments and in suppositories for temporary relief of pain and itching associated with skin and anorectal conditions.


name: 2-Furancarboxylic acid [4-(6-amino-3-tert-butyl-5-cyano-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl] ester


name: 4-nitrobenzoic acid (3,3,7,8-tetramethyl-1,5-dihydro-[1,3]dioxepino[5,6-c]pyridin-7-ium-9-yl) ester


name: 5-[[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)thio]methyl]-2-furancarboxylic acid methyl ester


name: 3-hydroxybenzoic acid [2-(1H-indol-3-yl)-2-oxoethyl] ester


name: DRD5_HUMAN D(1B) dopamine receptor (sprot)

description: A D(1B) dopamine receptor that is encoded in the genome of human.


name: Indolo[2,3-b]quinoxalin-6-yl-acetic acid ethyl ester


methacholine

A quaternary ammonium ion in which the nitrogen is substituted with three methyl groups and a 2-acetoxypropyl group. Parasympathomimetic bronchoconstrictor drug used in clinical diagnosis.


name: 2,2-Dioxo-6-phenyl-3,4-dihydrothiazolo[2,3-c][1,2,4]thiadiazine-7-carboxylic acid ethyl ester


name: 2-sulfanylidene-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester


name: 3,7-dimethyl-4H-1,4-benzothiazine-2-carboxylic acid 2-ethoxyethyl ester


name: DRD1_HUMAN D(1A) dopamine receptor (sprot)

description: A D(1A) dopamine receptor that is encoded in the genome of human.


name: 3-(3-Chloro-4-morpholin-4-yl-2,5-dioxo-2,5-dihydro-pyrrol-1-yl)-benzoic acid methyl ester


name: 5-amino-3-(4-methoxyphenyl)-4-oxo-1-thieno[3,4-d]pyridazinecarboxylic acid ethyl ester


name: 2-[[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]amino]benzoic acid methyl ester


name: 3-amino-5-phenyl-2-thiophenecarboxylic acid ethyl ester


name: 5-(4-Carboxy-benzenesulfonylamino)-2-methyl-benzofuran-3-carboxylic acid 2-methoxy-ethyl ester


name: 2-[[5-[[2-(3-chloroanilino)-4-thiazolyl]methyl]-4-(3-methoxypropyl)-1,2,4-triazol-3-yl]thio]acetic acid methyl ester


benserazide

A carbohydrazide that results from the formal condensation of the carboxy group of DL-serine with the primary amino group of 4-(hydrazinylmethyl)benzene-1,2,3-triol. An aromatic-L-amino-acid decarboxylase inhibitor (DOPA decarboxylase inhibitor) that does not enter the central nervous system, it is used as its hydrochloride salt as an adjunct to levodopa in the treatment of parkinsonism. By preventing the conversion of levodopa to dopamine in the periphery, it causes an increase in the amount of levodopa reaching the central nervous system and so reduces the required dose. Benserazide has no antiparkinson actions when given alone.


name: TF65_HUMAN Transcription factor p65 (sprot)

description: A transcription factor p65 that is encoded in the genome of human.


name: (3-Cyano-7-methyl-quinolin-2-ylsulfanyl)-acetic acid ethyl ester


name: (3-Cyano-7-methoxy-quinolin-2-ylsulfanyl)-acetic acid ethyl ester


name: 4-(6-Methyl-benzooxazol-2-yl)-benzoic acid methyl ester


name: (3-Cyano-7-ethoxy-quinolin-2-ylsulfanyl)-acetic acid methyl ester


name: 2-[(Thiophene-2-carbonyl)-amino]-benzothiazole-6-carboxylic acid ethyl ester


name: (3-Cyano-7-methoxy-quinolin-2-ylsulfanyl)-acetic acid methyl ester


name: 5-Pyrimidinecarboxylic acid, 4-amino-2-[(phenylmethyl)thio]-, ethyl ester


name: benzoic acid (2-oxo-2-thiophen-2-ylethyl) ester


indoprofen

A monocarboxylic acid that is propionic acid in which one of the hydrogens at position 2 is substituted by a 4-(1-oxo-1,3-dihydroisoindol-2-yl)phenyl group. Initially used as an anti-inflammatory and analgesic, it was withdrawn from the market due to causing severe gastrointestinal bleeding. It has been subsequently found to increase production of the survival motor neuron protein.


name: 4-amino-2-(butylthio)-5-pyrimidinecarboxylic acid ethyl ester


name: 1-(4-bromophenyl)-4-[1-naphthalenyl(oxo)methyl]-3-pyrazolecarboxylic acid ethyl ester


name: 5-methyl-1-phenyl-4-pyrazolecarboxylic acid (4-methoxyphenyl) ester


name: N-[3-[[diethylamino(sulfanylidene)methyl]thio]-1-oxopropyl]carbamic acid (4-propan-2-ylphenyl) ester


name: N-[3-[[diethylamino(sulfanylidene)methyl]thio]-1-oxopropyl]carbamic acid (4-methylphenyl) ester


name: N-[3-[[diethylamino(sulfanylidene)methyl]thio]-1-oxopropyl]carbamic acid (4-tert-butylphenyl) ester


name: (2-Phenyl-benzothiazol-5-yl)-acetic acid methyl ester


name: 5-Benzothiazoleacetic acid, 2-phenyl-, ethyl ester


name: 2-(Benzooxazol-2-ylamino)-4-diethylthiocarbamoylsulfanylmethyl-pyrimidine-5-carboxylic acid ethyl ester


name: 6-(4-chlorophenyl)-2-methyl-3-pyridinecarboxylic acid methyl ester


name: 2-nitrobenzoic acid [1-(4-methylphenyl)-1-oxopropan-2-yl] ester


name: 2-(2,4-dichlorophenoxy)acetic acid [[amino(2-pyridinyl)methylidene]amino] ester


PECTOLINARIGENIN

A dimethoxyflavone that is the 6,4'-dimethyl ether derivative of  scutellarein.


name: N-(2-methoxyphenyl)carbamic acid (p-anisylideneamino) ester


omeprazole

A member of the class of benzimidazoles that is 1H-benzimidazole which is substituted by a [4-methoxy-3,5-dimethylpyridin-2-yl)methyl]sulfinyl group at position 2 and a methoxy group at position 5.


The anion resulting from the removal of the proton from the carboxylic acid group of 3,3',5-triiodo-L-thyronine.


prochlorperazine

A member of the class of phenothiazines that is 10H-phenothiazine having a chloro substituent at the 2-position and a 3-(4-methylpiperazin-1-yl)propyl group at the N-10 position.


name: 2-[[4-Amino-5-[[4-(dimethylamino)phenyl]carbamoyl]thiazol-2-yl]thio]acetic acid ethyl ester


name: 5-Hydroxy-2-methyl-4-[morpholino(4-pyridyl)methyl]benzo[g]benzofuran-3-carboxylic acid ethyl ester


An  anthracenetriol that is anthracene substituted by hydroxy groups at positions 1, 8 and 9.


name: 2-keto-6-methyl-4-(3-thienyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid isobutyl ester


name: 4-(1-Carbomethoxy-2,2,2-trifluoro-1-hydroxy-ethyl)-5-(dimethylaminomethyleneamino)furan-2-carboxylic acid ethyl ester


name: (5Z)-5-(4-hydroxy-3,5-dimethoxy-benzylidene)-4-keto-2-(p-anisidino)thiophene-3-carboxylic acid ethyl ester


name: 2-[(E)-2-Cyano-3-(4-hydroxy-3-methoxy-phenyl)-acryloylamino]-4-p-tolyl-thiophene-3-carboxylic acid ethyl ester


ALTENUSIN

A carboxybiphenyl that is [biphenyl]-2-carboxylic acid which is substituted by a hydroxy group at positions 3, 4' and 5', methoxy group at position 5 and a methyl group at position 2'. It is a a metabolite isolated from Alternaria  and several other fungal species.


PURPUROGALLIN

A cyclic ketone that is 5H-benzocycloheptene bearing an oxo group at position 5 and hydroxy groups at positions 2, 3, 4 and 6.


ROSMARINIC ACID

A stereoisomer of rosmarinic acid having (R)-configuration.


GP42_EBVA8 Glycoprotein 42 (sprot)

A protein that is a translation product of the BZLF2 gene in Epstein-barr virus strain ag876.


name: 1-[3-[1-cyano-2-oxo-2-[(phenylmethyl)amino]ethyl]-2-quinoxalinyl]-3-piperidinecarboxylic acid ethyl ester


name: 2-cyano-2-[3-(4-morpholinyl)-2-quinoxalinyl]acetic acid hexyl ester


name: 2-(2-cyanophenoxy)acetic acid [2-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-2-oxoethyl] ester


name: 4-[[3-[(4-chlorophenyl)sulfonylamino]-2-quinoxalinyl]amino]-1-piperidinecarboxylic acid ethyl ester


PAXILLINE

An indole diterpene alkaloid with formula C27H33NO4 isolated from Penicillium paxilli. It is a potent inhibitor of large conductance Ca2(+)- and voltage-activated K(+) (BK)-type channels.


name: (9-Methoxy-indolo[2,3-b]quinoxalin-6-yl)-acetic acid isopropyl ester


name: 4,5-dimethylcyclopenta[c]quinolizine-1,2-dicarboxylic acid dimethyl ester


name: (Z)-2-Cyano-3-{4-[4-((E)-3-phenyl-allyl)-piperazin-1-yl]-phenyl}-acrylic acid ethyl ester


name: 2-[1-(phenylmethyl)-2-isoquinolin-2-iumyl]acetic acid ethyl ester


name: (4Z)-4-piperonylidene-2,3-dihydro-1H-acridine-9-carboxylic acid [2-(2,6-dimethylanilino)-2-keto-ethyl] ester


name: [3-(2-Amino-5-bromo-phenyl)-2-oxo-2H-quinoxalin-1-yl]-acetic acid ethyl ester


name: 5-(4-Chlorobenzoyl)-4-(4-methoxyphenyl)-2-pyrazoline-3-carboxylic acid ethyl ester


name: 3-(2,6-Dichlorophenyl)-5-methyl-4-isoxazolecarboxylic acid [1-(2-pyrazinyl)ethylideneamino] ester


lysergol

An alkaloid of the ergoline family that occurs as a minor constituent in some species of fungi and in the morning glory family of plants. Its structure is that of ergoline with a methyl group at N-6 and a beta-hydroxymethyl substituent at C-8.


name: 5-[(4-chlorophenyl)-oxomethyl]-2-(dimethylaminomethylidene)-3-oxo-7-pyrrolo[2,1-b]thiazolecarboxylic acid methyl ester


name: (1R,2R,3R,8aS)-6-acetyl-3-carbamoyl-1-cyano-2-(4-fluorophenyl)-3,8a-dihydro-2H-indolizine-1-carboxylic acid methyl ester


name: 2-Thiophenecarboxylic acid [2-(3-cyanophenyl)-3-(4-methoxy-4-oxobutyl)-7-methyl-6,8-dioxo-7-isoquinolinyl] ester


name: 4-Methoxybenzoic acid [3-butyl-5-(2-furanyl)-7-methyl-6,8-dioxo-2-[2-(2-pyridinyl)ethyl]-7-isoquinolinyl] ester


name: RAD51_HUMAN DNA repair protein RAD51 homolog 1 (sprot)

description: A DNA repair protein RAD51 homolog 1 that is encoded in the genome of human.


name: 2-[(2,5-Dichlorophenyl)hydrazono]-2-(2,6-dimethylmorpholino)acetic acid ethyl ester


name: RMLC_MYCTO dTDP-4-dehydrorhamnose 3,5-epimerase (sprot)


name: 4-(3-Cyano-4,6-dimethyl-pyridin-2-ylsulfanyl)-3-oxo-butyric acid methyl ester


name: 4-(3-Cyano-5,6,7,8-tetrahydro-quinolin-2-ylsulfanyl)-3-oxo-butyric acid isopropyl ester


name: 4-(3-Cyano-6-methyl-quinolin-2-ylsulfanyl)-3-oxo-butyric acid ethyl ester


name: 4-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]-3-oxobutanoic acid propan-2-yl ester


name: N-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]carbamic acid ethyl ester


name: 1-(4-fluorophenyl)-3-methyl-5-thieno[2,3-c]pyrazolecarboxylic acid (2-oxo-3-oxolanyl) ester


name: 4-(3-Methoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester


name: 4-(3-Cyano-4,6-dimethyl-pyridin-2-ylsulfanyl)-3-oxo-butyric acid ethyl ester


4-methylumbelliferyl acetate

An acetate ester consiting of umbelliferone carrying a 7-O-acetyl group.


name: (Z)-3-(1-naphthylamino)-2-nitro-acrylic acid methyl ester


name: 6-amino-5-cyano-2-[[(3-cyano-6-phenyl-2-pyridinyl)thio]methyl]-4-(3-pyridinyl)-4H-pyran-3-carboxylic acid ethyl ester


name: (7-Dimethylcarbamoylmethoxy-4-methyl-2-oxo-2H-chromen-3-yl)-acetic acid methyl ester


name: 4-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio]-3-oxobutanoic acid ethyl ester


name: 2-ethoxy-3-pyridinecarboxylic acid (4-methoxycarbonylphenyl)methyl ester


name: 8-methoxy-4-oxo-1H-quinoline-2-carboxylic acid methyl ester


hymecromone

A hydroxycoumarin that is umbelliferone substituted by a methyl group at position 4.


topotecan

A pyranoindolizinoquinoline used as an antineoplastic agent. It is a derivative of camptothecin and works by binding to the topoisomerase I-DNA complex and preventing religation of these 328 single strand breaks.


name: RGS4_HUMAN Regulator of G-protein signaling 4 (sprot)

description: A regulator of G-protein signaling 4 that is encoded in the genome of human.


name: (2-{2-[5-(4-Fluoro-phenyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-acetylamino}-thiazol-4-yl)-acetic acid ethyl ester


name: 1-Benzyl-3-(4-fluoro-phenyl)-5-methyl-4,6-dioxo-octahydro-pyrrolo[3,4-c]pyrrole-1-carboxylic acid methyl ester


An aminopyrimidine compound having its amino group at position 2 and chloro and methyl substituents at positions 4 and 6 respectively.


name: 2-[4-(2,6-Dimethylmorpholino)butoxy]benzoic acid methyl ester;oxalic acid


name: M4K2_HUMAN Mitogen-activated protein kinase kinase kinase kinase 2 (sprot)

description: A mitogen-activated protein kinase kinase kinase kinase 2 that is encoded in the genome of human.


name: Pentanedioic acid cyclopentyl-cyclopentylcarbamoylmethyl-amide pyridin-2-ylamide


name: 4-[[(Z)-2-cyano-2-[4-(4-methoxyphenyl)-2-thiazolyl]ethenyl]amino]benzoic acid 2-(diethylamino)ethyl ester


name: 4-[[(Z)-2-cyano-2-[4-(3,4-dimethoxyphenyl)-2-thiazolyl]ethenyl]amino]benzoic acid 2-(diethylamino)ethyl ester


name: 4-[[(Z)-2-[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]-2-cyanoethenyl]amino]benzoic acid 2-(diethylamino)ethyl ester


name: 4-[[(Z)-2-cyano-2-[4-(3-methoxyphenyl)-2-thiazolyl]ethenyl]amino]benzoic acid 2-(diethylamino)ethyl ester


A member of the class of coumarins that is 5,7-dimethoxy-2H-chromen-2-one substituted by a pentyl group and a 1-[4-(dimethylamino)phenyl]-3-(pyrrolidin-1-yl)propyl group at positions 4 and 8, respectively.


name: 4-[[(Z)-2-cyano-2-[4-(2-ketochromen-3-yl)thiazol-2-yl]vinyl]amino]benzoic acid 2-(diethylamino)ethyl ester


clofazimine

3-Isopropylimino-3,5-dihydro-phenazine in which the hydrogen at position 5 is substituted substituted by a 4-chlorophenyl group, and that at position 2 is substituted by a (4-chlorophenyl)amino group. A dark red crystalline solid, clofazimine is an antimycobacterial and is one of the main drugs used for the treatment of  multi-bacillary leprosy. However, it can cause red/brown discolouration of the skin, so other treatments are often preferred in light-skinned patients.


chlorhexidine

A bisbiguanide compound with a structure consisting of two (p-chlorophenyl)guanide units linked by a hexamethylene bridge.


name: MEX5_CAEEL Zinc finger protein mex-5 (sprot)

description: A protein that is a translation product of the mex-5 gene in worm.


name: (8S,8aR)-6-amino-5,7,7-tricyano-8-(3-pyridinyl)-1,3,8,8a-tetrahydroisoquinoline-2-carboxylic acid tert-butyl ester


name: 1,3-benzothiazole-6-carboxylic acid [2-(2-furanyl)-2-oxoethyl] ester


name: 4-[[2-[[cyclohexyl(oxo)methyl]amino]-1-oxo-3-phenylpropyl]amino]-1-piperidinecarboxylic acid ethyl ester


name: Pyrrolo(1,2-b)isoquinoline-1,2-dicarboxylic acid, 5,10-dihydro-3-methyl-, dimethyl ester


name: 4-(4-isopropoxy-3-methoxy-phenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid isopropyl ester


name: 7-anilino-1-(4-methylphenyl)-5-oxo-[1,2,4]triazolo[4,3-a]pyrimidine-3-carboxylic acid ethyl ester


name: 3-amino-2-cyano-5-(3-methoxyphenyl)-7-methyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester


name: 4-Methyl-benzoic acid 4-{[(E)-4-dimethylamino-phenylimino]-methyl}-2-phenyl-oxazol-5-yl ester


name: {2-[(3-Amino-7-methyl-thieno[2,3-b]quinoline-2-carbonyl)-amino]-thiazol-4-yl}-acetic acid ethyl ester


name: 3-(3-formyl-2,5-dimethyl-1-pyrrolyl)-4-methylbenzoic acid methyl ester


methylthioninium chloride

An organic cation that is phenothiazin-5-ium substituted by dimethylamino groups at positions 3 and 7. The chloride salt is the histological dye 'methylene blue'.


name: 1,5-dioxo-2,4-dihydropyrrolo[1,2-a]quinazoline-3-carboxylic acid ethyl ester


violaceol II

An aromatic ether in which the ether functionality links a 2,3-dihydroxy-5-methylphenyl group with a 2,6-dihydroxy-4-methylphenyl group. Fungal metabolite isolated inter alia from Aspergillus spp.


name: Acetic acid 4-{[(E)-4-dimethylamino-phenylimino]-methyl}-2-phenyl-oxazol-5-yl ester


name: (5E)-5-(2-furanylmethylidene)-2-methyl-4-oxo-1-phenyl-3-pyrrolecarboxylic acid methyl ester


A member of the class of chalcones that is trans-chalcone substituted by hydroxy groups at positions 2', 3 and 4. The precursor of 3',4'-dihydroxyaurone.


tolonium

An organic cation that is phenothiazin-5-ium substituted by methyl, amino and dimethylamino groups at positions 2, 3 and 7 respectively. The chloride salt is used as a  histological dye.


name: 6-Chloronicotinic acid [5-bromo-6,8-diketo-3-(4-methoxyphenyl)-7-methyl-isochromen-7-yl] ester


name: 4-(7-Hydrocinnamoyloxy-6,8-diketo-7-methyl-isochromen-3-yl)butyric acid methyl ester


name: 4-Methoxybenzoic acid [3-butyl-5-(2-furyl)-6,8-diketo-7-methyl-2-(2-morpholinoethyl)-7-isoquinolyl] ester


name: 4-Methoxybenzoic acid [3-butyl-2-cyclopropyl-5-(2-furanyl)-7-methyl-6,8-dioxo-7-isoquinolinyl] ester


3,4-DIHYDROXYPHENYLACETIC ACID

A dihydroxyphenylacetic acid having the two hydroxy substituents located at the 3- and 4-positions. It is a metabolite of dopamine.


name: Propionic acid [3-[4-(tert-butoxycarbonylamino)butyl]-6,8-diketo-7-methyl-isochromen-7-yl] ester


name: 6-Chloronicotinic acid [6,8-diketo-7-methyl-3-(3-thienyl)isochromen-7-yl] ester


name: 6-Chloronicotinic acid [3-[3-(tert-butoxycarbonylamino)propyl]-6,8-diketo-7-methyl-isochromen-7-yl] ester


name: Quinoxaline-2-carboxylic acid [3-[4-(tert-butoxycarbonylamino)butyl]-6,8-diketo-7-methyl-isochromen-7-yl] ester


name: Cyclopentanecarboxylic acid [3-[3-(tert-butoxycarbonylamino)propyl]-6,8-diketo-7-methyl-isochromen-7-yl] ester


name: Furan-2-carboxylic acid [3-[3-(tert-butoxycarbonylamino)propyl]-6,8-diketo-7-methyl-isochromen-7-yl] ester


name: Furan-2-carboxylic acid [3-[4-(tert-butoxycarbonylamino)butyl]-6,8-diketo-7-methyl-isochromen-7-yl] ester


A racemate comprising equimolar amounts of (R)- and (S)-SKF 38393


yohimbine

An indole alkaloid with alpha2-adrenoceptor antagonist activity. It is produced by Corynanthe johimbe and Rauwolfia serpentina.


neutral red base

A member of the class of phenazines carrying methyl, amino and dimethylamino substituents at positions 2, 3 and 7 respectively. The free base of neutral red, which acts as a pH indicator, changing from red to yellow between pH 6.8 and 8.0.


name: [3-(1,3-Dimethyl-2,4,6-trioxo-tetrahydro-pyrimidin-5-ylidenemethyl)-indol-1-yl]-acetic acid methyl ester


name: 2-[2-(2-Carboxy-ethyl)-5-phenyl-pyrrol-1-yl]-benzoic acid methyl ester


name: [3-(2,4,6-Trioxo-1-phenyl-tetrahydro-pyrimidin-5-ylidenemethyl)-indol-1-yl]-acetic acid methyl ester


AGROCLAVINE

An ergot alkaloid that is ergoline which contains a double bond between positions 8 and 9, and which is substituted by methyl groups at positions 6 and 8.


name: [3-(2,4,6-Trioxo-tetrahydro-pyrimidin-5-ylidenemethyl)-indol-1-yl]-acetic acid methyl ester


name: (3Z)-5,6-dimethoxy-3-[(phenylhydrazo)methylidene]-2-indolecarboxylic acid methyl ester


name: N-[(1S,3S)-3-(2,2,2-trichloroethoxysulfonylamino)indan-1-yl]sulfamic acid 2,2,2-trichloroethyl ester


A gallate ester obtained by the formal condensation of gallic acid with the (3R)-hydroxy group of (-)-epigallocatechin.


name: 4-[(2E)-3-keto-2-veratrylidene-4H-1,4-benzothiazine-6-carbonyl]piperazine-1-carboxylic acid ethyl ester


rosmarinic acid (racemate)

The 1-carboxy-2-(2,4-dihydroxyphenyl)ethyl ester of trans-caffeic acid.


name: 1-[(2E)-3-keto-2-(4-methylbenzylidene)-4H-1,4-benzothiazine-6-carbonyl]isonipecotic acid ethyl ester


name: 3-(2-Methoxyphenyl)propionic acid [2-[2-keto-2-(o-toluidino)ethyl]thiazol-4-yl]methyl ester


name: N-[1-benzyl-2-[4-[[2-(4-fluoroanilino)-2-keto-ethyl]carbamoyl]piperidino]-2-keto-ethyl]carbamic acid tert-butyl ester


verbascoside

A glycoside that is the alpha-L-rhamnosyl-(1->3)-beta-D-glucoside of hydroxytyrosol in which the hydroxy group at position 4 of the glucopyranosyl moiety has undergone esterification by formal condensation with trans-caffeic acid.


name: (E)-2-cyano-3-[4-(dimethylamino)phenyl]acrylic acid [2-(4-acetamidoanilino)-2-keto-1-methyl-ethyl] ester


name: ESS1_YEAST Peptidyl-prolyl cis-trans isomerase ESS1 (sprot)

description: A peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 that is encoded in the genome of yeast.


name: UCHL1_MOUSE Ubiquitin carboxyl-terminal hydrolase isozyme L1 (sprot)

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


name: UCHL3_MOUSE Ubiquitin carboxyl-terminal hydrolase isozyme L3 (sprot)

description: A ubiquitin carboxyl-terminal hydrolase isozyme L3 that is encoded in the genome of mouse.


name: (4S,5S,6R)-1-benzyl-2-keto-6-methyl-4-phenethyl-hexahydropyrimidine-5-carboxylic acid methyl ester


name: 4-Benzyl-4H-thieno[3,2-b]pyrrole-5-carboxylic acid ethyl ester


beclometasone

A 17alpha-hydroxy steroid that is prednisolone in which the hydrogens at the 9alpha and 16beta positions are substituted by a chlorine and a methyl group, respectively.


name: Thiophene-2-carboxylic acid 1-[(furan-2-ylmethyl)-carbamoyl]-2-methyl-propyl ester


A cephalosporin carboxylate anion having (R)-mandelamido and N-methylthiotetrazole side-groups.


name: 4-(diethylamino)benzoic acid [2-oxo-2-(4-phenyl-1-piperazinyl)ethyl] ester


name: benzoic acid [5-(6-benzamido-9-purinyl)-3-fluoro-4-hydroxy-2-oxolanyl]methyl ester


name: 3-[(4-phenyl-1-piperazinyl)sulfonyl]benzoic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester


A member of the class of triazoles that is 2H-1,2,3-triazole carrying two phenyl substituents at positions 4 and 5.


name: 3-butyl-5-(4-morpholinylmethyl)-2-oxo-3-oxolanecarboxylic acid ethyl ester


ISOQUERCETIN

A quercetin O-glucoside that is quercetin with a beta-D-glucosyl residue attached at position 3. Isolated from Lepisorus contortus, it exhibits antineoplastic activityand has been found to decrease the rate of polymerization and sickling of red blood cells


name: 4-[2,5-Diketo-3-[[2-keto-2-(4-sulfamoylanilino)ethyl]thio]pyrrolidino]benzoic acid ethyl ester


bufexamac

A hydroxamic acid derived from phenylacetamide in which the benzene moiety is substituted at C-4 by a butoxy group. It has anti-inflammatory, analgesic, and antipyretic properties.


name: 2-(6-amino-5-cyano-2''-oxo-3-thiophen-2-yl-1''-spiro[2H-pyrano[2,3-c]pyrazole-4,3''-indole]yl)acetic acid methyl ester


ursodeoxycholic acid

A bile acid found in the bile of bears (Ursidae) as a conjugate with taurine. Used therapeutically, it prevents the synthesis and absorption of cholesterol and can lead to the dissolution of gallstones.


name: benzoic acid [[1-(4-nitrophenyl)-4-piperidinylidene]amino] ester


name: 2-Benzenesulfonylamino-1-butyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylic acid ethyl ester


name: 3-pyridinecarboxylic acid [2-(2-furanyl)-4-oxo-1-benzopyran-3-yl] ester


name: (2S)-4-methyl-2-[[[5-(methylcarbamoyl)-1H-imidazol-4-yl]-oxomethyl]amino]pentanoic acid tert-butyl ester


name: NOD2_HUMAN Nucleotide-binding oligomerization domain-containing protein 2 (sprot)

description: A nucleotide-binding oligomerization domain-containing protein 2 that is encoded in the genome of human.


name: 3-methyl-2-benzofurancarboxylic acid [2-[4-amino-1-methyl-3-(2-methylpropyl)-2,6-dioxo-5-pyrimidinyl]-2-oxoethyl] ester


A member of the class of  pyridobenzimidazoles that is pyrido[1,2-a]benzimidazole substituted by amino, cyano, 4-methylphenyl, and cyano groups at positions 1, 2, 3 and 4, respectively. It is a potent inhibitor of ferroptosis suppressor protein 1 (FSP1) with EC50 of 103 nM. It induces ferroptosis in GPX4 knockout cells that overexpress FSP1.


MORONIC ACID

A pentacyclic triterpenoid that is olean-18-ene substituted at position 3 by an oxo group and position 28 by a carboxy group.


name: 2-[(2,5-dimethylphenyl)thio]acetic acid [3-(1H-benzimidazol-2-yl)-3-cyano-2-oxopropyl] ester


name: UBC9_HUMAN SUMO-conjugating enzyme UBC9 (sprot)

description: A SUMO-conjugating enzyme UBC9 that is encoded in the genome of human.


name: 2-(Tert-butoxycarbonylamino)propionic acid (2-ketochromen-7-yl) ester


name: 1-(1-Phenylamino-but-3-enyl)-7-oxa-bicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylic acid dimethyl ester


name: 2-Hydroxy-5-(2-thienylsulfonylamino)benzoic acid [2-(2,5-dichloroanilino)-2-keto-ethyl] ester


name: (E)-2-cyano-3-(4-methoxyphenyl)acrylic acid [2-[(2-chlorobenzyl)amino]-2-keto-ethyl] ester


name: 3-[5-[bis(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]-2-furanyl]benzoic acid methyl ester


The anion formed from naproxen by loss of a proton from the carboxy group.


ketoprofen

An oxo monocarboxylic acid that consists of propionic acid substituted by a 3-benzoylphenyl group at position 2.


fenoprofen

A monocarboxylic acid that is propanoic acid in which one of the hydrogens at position 2 is substituted by a 3-phenoxyphenyl group. A non-steroidal anti-inflammatory drug, the dihydrate form of the calcium salt is used for the management of mild to moderate pain and for the relief of pain and inflammation associated with  disorders such as arthritis. It is pharmacologically similar to aspirin, but causes less gastrointestinal bleeding.


6-METHOXY-2-NAPHTHYLACETIC ACID

A monocarboxylic acid consisting of 2-naphthylacetic acid having a methoxy substituent at the 6-position. The active metabolite of the prodrug nabumetone.


SULINDAC SULFIDE

An  aryl sulfide that is a metabolite of  sulindac. A non-steroidal anti-inflammatory drug, which also has anticancer activity.


name: RAB7A_CANLF Ras-related protein Rab-7a (sprot)

description: A Ras-related protein Rab-7a that is encoded in the genome of dog.


name: APBA1_RAT Amyloid-beta A4 precursor protein-binding family A member 1 (sprot)

description: An amyloid-beta A4 precursor protein-binding family A member 1 that is encoded in the genome of rat.


PLEC_HUMAN Plectin (sprot)

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


naloxone

A synthetic morphinane alkaloid that is morphinone in which the enone double bond has been reduced to a single bond, the hydrogen at position 14 has been replaced by a hydroxy group, and the methyl group attached to the nitrogen has been replaced by an allyl group. A specific opioid antagonist, it is used (commonly as its hydrochloride salt) to reverse the effects of opioids, both following their use of opioids during surgery and in cases of known or suspected opioid overdose.


name: N-[2,2,2-trichloro-1-[[(2,6-dichloroanilino)-sulfanylidenemethyl]amino]ethyl]carbamic acid (phenylmethyl) ester


STRP_STRP1 Streptokinase A (sprot)

A protein that is a translation product of the ska gene in Streptococcus pyogenes serotype M1.


name: 2-[(5-Bromo-furan-2-carbonyl)-amino]-1-butyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylic acid ethyl ester


name: 4-(4-Hydroxyanilino)-1-(4-hydroxyphenyl)-2-methyl-5-oxo-2-pyrrolecarboxylic acid ethyl ester


name: M3K3_HUMAN Mitogen-activated protein kinase kinase kinase 3 (sprot)

description: A mitogen-activated protein kinase kinase kinase 3 that is encoded in the genome of human.


name: RNT1_ASPOR Guanyl-specific ribonuclease T1 (sprot)

description: A guanyl-specific ribonuclease T1 that is encoded in the genome of Aspergillus oryzae RIB40.


name: GRM8_RAT Metabotropic glutamate receptor 8 (sprot)

description: A metabotropic glutamate receptor 8 that is encoded in the genome of rat.


name: GRM7_RAT Metabotropic glutamate receptor 7 (sprot)

description: A metabotropic glutamate receptor 7 that is encoded in the genome of rat.


name: GRM4_RAT Metabotropic glutamate receptor 4 (sprot)

description: A metabotropic glutamate receptor 4 that is encoded in the genome of rat.


name: ACM5_HUMAN Muscarinic acetylcholine receptor M5 (sprot)

description: A muscarinic acetylcholine receptor M5 that is encoded in the genome of human.


name: GRM2_HUMAN Metabotropic glutamate receptor 2 (sprot)

description: A metabotropic glutamate receptor 2 that is encoded in the genome of human.


name: GRM3_RAT Metabotropic glutamate receptor 3 (sprot)

description: A metabotropic glutamate receptor 3 that is encoded in the genome of rat.


name: GRM6_HUMAN Metabotropic glutamate receptor 6 (sprot)

description: A metabotropic glutamate receptor 6 that is encoded in the genome of human.


name: GRM1_RAT Metabotropic glutamate receptor 1 (sprot)

description: A metabotropic glutamate receptor 1 that is encoded in the genome of rat.


name: GRM4_HUMAN Metabotropic glutamate receptor 4 (sprot)

description: A metabotropic glutamate receptor 4 that is encoded in the genome of human.


name: GRM5_RAT Metabotropic glutamate receptor 5 (sprot)

description: A metabotropic glutamate receptor 5 that is encoded in the genome of rat.


name: NCF1_HUMAN Neutrophil cytosol factor 1 (sprot)

description: A neutrophil cytosol factor 1 that is encoded in the genome of human.


name: 5-Ethyl-3-(4-hydroxy-3-methoxy-phenyl)-1-methyl-4,6-dioxo-octahydro-pyrrolo[3,4-c]pyrrole-1-carboxylic acid methyl ester


name: 3,4-dimethoxybenzoic acid [2-(3,4-dimethoxyphenyl)-2-oxoethyl] ester


name: 2-(4-Chloroanilino)-4-oxo-3-thiophenecarboxylic acid ethyl ester


name: 4-(2-Hydroxy-ethylamino)-6-methyl-quinoline-3-carboxylic acid ethyl ester


name: [3-(2-Methylamino-phenyl)-2-oxo-2H-quinoxalin-1-yl]-acetic acid ethyl ester


name: Acetic acid 7-bromo-1-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl ester


tolazoline

A member of the class of imidazoles that is 4,5-dihydro-1H-imidazole substituted by a benzyl group.


name: 5-bromo-3-pyridinecarboxylic acid [3-(3-methylphenoxy)-4-oxo-1-benzopyran-7-yl] ester


name: 4-[3-(4-Hydroxyanilino)-2,5-diketo-pyrrolidino]benzoic acid ethyl ester


name: 3,5,7-trimethyl-1-adamantanecarboxylic acid 2-(4-methyl-3-phenacyl-5-thiazol-3-iumyl)ethyl ester


name: acetic acid [1-[(4,8-dimethoxy-7-furo[2,3-b]quinolinyl)oxy]-3-hydroxy-3-methylbutan-2-yl] ester


name: 5-Acetoxy-6-bromo-2-carbamimidoylsulfanylmethyl-1-methyl-1H-indole-3-carboxylic acid octyl ester


CIRSIMARITIN

A dimethoxyflavone that is flavone substituted by methoxy groups at positions 6 and 7 and hydroxy groups at positions 5 and 4' respectively.


name: 3-phenylpropanoic acid [3-(4-cyanophenyl)-7-methyl-6,8-dioxo-2-[2-(2-pyridinyl)ethyl]-7-isoquinolinyl] ester


KLK5_HUMAN Kallikrein-5 (sprot)

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


name: 2-{[1-(4-Fluoro-phenyl)-5-oxo-pyrrolidine-3-carbonyl]-amino}-benzoic acid methyl ester


name: 2-(4-Ethylamino-6-morpholin-4-yl-[1,3,5]triazin-2-ylsulfanyl)-propionic acid methyl ester


name: [2-tert-Butoxycarbonylamino-3-(1H-indol-3-yl)-propionylamino]-acetic acid methyl ester


name: Furan-2-carboxylic acid cyclohexylcarbamoyl-(3,4-dimethoxy-phenyl)-methyl ester


name: [3-(Thiophene-2-carbonyl)-indol-1-yl]-acetic acid methyl ester


name: (5-Furan-2-yl-4-p-tolyl-4H-[1,2,4]triazol-3-ylsulfanyl)-acetic acid ethyl ester


name: 2-[5-(4-Butoxy-phenyl)-tetrazol-2-yl]-2-methyl-propionic acid methyl ester


name: 2-(2,5-Dimethyl-benzenesulfonylamino)-4-methyl-thiazole-5-carboxylic acid ethyl ester


name: 1-[2,5-Diketo-1-(p-tolyl)pyrrolidin-3-yl]nipecotic acid ethyl ester


name: Furan-2-carboxylic acid 4-acetylamino-phenyl ester


name: {2-[(3-Amino-6-ethyl-thieno[2,3-b]quinoline-2-carbonyl)-amino]-thiazol-4-yl}-acetic acid ethyl ester


name: N-(4-methylphenyl)carbamic acid (cyclopentylideneamino) ester


name: 2-(2-methyl-1-benzimidazolyl)acetic acid [2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] ester


name: 6,8-Dimethyl-[1,3]dioxolo[4,5-g]quinoline-7-carboxylic acid allyl ester;hydrochloride


A thienopyrimidine that is thieno[2,3-d]pyrimidine which is substituted at position 4 by a benzylsulfanediyl group.


name: 2-Morpholino-2-[[3-(trifluoromethyl)phenyl]hydrazono]acetic acid ethyl ester


carbaryl

A carbamate ester obtained by the formal condensation of  1-naphthol with methylcarbamic acid.


name: Di-morpholin-4-yl-phosphinic acid 2,2,3,3-tetrafluoro-propyl ester


name: 2-[4-[2-(1-cyclohexenyl)ethylsulfamoyl]-2-methylphenoxy]acetic acid methyl ester


name: (Z)-3-(3-chloro-2-methyl-anilino)-2-[3-chloro-5-(trifluoromethyl)-2-pyridyl]acrylic acid methyl ester


name: (4S,5R,6R)-1-(2-ethoxy-2-keto-ethyl)-2-keto-6-methyl-4-phenethyl-hexahydropyrimidine-5-carboxylic acid methyl ester


dihydrosphingosine

A 2-aminooctadecane-1,3-diol having (2S,3R)-configuration.


estradiol benzoate

A benzoate ester resulting from the formal condensation of benzoic acid with the phenolic hydroxy group of 17beta-estradiol.


cefaclor

A cephalosporin bearing chloro and (R)-2-amino-2-phenylacetamido groups at positions 3 and 7, respectively, of the cephem skeleton.


name: 4-[[2-(dimethylamino)-2-thiophen-2-ylethyl]amino]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester


name: 2-(6-imidazo[2,1-b]thiazolyl)acetic acid [2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl] ester


name: 5-[(4-methyl-1-piperidinyl)methyl]-1-[4-(1-pyrrolyl)-1,2,5-oxadiazol-3-yl]-4-triazolecarboxylic acid ethyl ester


nitrofurantoin

An imidazolidine-2,4-dione that is hydantoin substituted at position 1 by a [(5-nitro-2-furyl)methylene]amino group. An antibiotic that damages bacterial DNA.


A cephalosporin carboxylic acid anion having methoxy, 2-thienylacetamido and carbamoyloxymethyl side-groups, formed by proton loss from the carboxy group of the semisynthetic cephamycin antibiotic cefoxitin.


metformin

A member of the class of guanidines that is biguanide the carrying two methyl substituents at position 1.


name: 2-Adamantanecarboxylic acid 2-[3-[2-(4-bromophenyl)-2-oxoethyl]-4-methyl-5-thiazol-3-iumyl]ethyl ester;bromide


name: 2-(2-Anilinothiazol-4-yl)-2-(phenylhydrazono)acetic acid ethyl ester


name: 4-[7-[(4-Fluorophenyl)carbamoyl]-1-keto-isoindolin-2-yl]piperidine-1-carboxylic acid ethyl ester


name: 4-(4-Chlorophenyl)-5-cyano-6-(ethylthio)-2-methyl-1,4-dihydropyridine-3-carboxylic acid allyl ester


name: 2-(2-Anilino-4-thiazolyl)-2-[(4-chlorophenyl)hydrazinylidene]acetic acid ethyl ester


name: 5-Hydroxy-2-methyl-4-[morpholino(phenyl)methyl]benzo[g]benzofuran-3-carboxylic acid ethyl ester


name: 4-[4-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-1-piperidinyl]-3-nitrobenzoic acid methyl ester


name: 1-[4-(2-fluorophenyl)-2-thiazolyl]-5-(trifluoromethyl)-4-pyrazolecarboxylic acid ethyl ester


name: 4-Chloro-3-nitro-benzoic acid 4-quinoxalin-2-yl-phenyl ester


name: 4-(4-methylphenyl)-2-[[3-(4-morpholinyl)-1-oxopropyl]amino]-3-thiophenecarboxylic acid ethyl ester


name: Furan-2-carboxylic acid [3-[[(4-anilino-6-morpholino-s-triazin-2-yl)hydrazono]methyl]phenyl] ester


name: 2,2-diphenylacetic acid (2,6-dimethylphenyl) ester


name: 5-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester


name: (4Z)-4-piperonylidene-2,3-dihydro-1H-acridine-9-carboxylic acid [2-(4-carbamoylanilino)-2-keto-ethyl] ester


name: benzoic acid [2-oxo-2-[2-(phenylthio)anilino]ethyl] ester


name: 4-(carbamoylamino)benzoic acid [2-(3-chloro-4-methylanilino)-2-oxo-1-phenylethyl] ester


name: 2-(4-bromophenyl)cinchoninic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester


name: 4-(4-anilinoanilino)-2-quinazolinecarboxylic acid ethyl ester


name: 2-[4-(3-chlorophenyl)-1-piperazinyl]-3-pyridinecarboxylic acid propan-2-yl ester


pefloxacin

A quinolone that is 4-oxo-1,4-dihydroquinoline which is substituted at positions 1, 3, 6 and 7 by ethyl, carboxy, fluorine, and 4-methylpiperazin-1-yl groups, respectively.


name: 2,3-(4', 3'-Pyrazolo)pregna-4,6-dien-20-one, 11beta,17-dihydroxy-6, 16alpha-dimethyl-2'-phenyl-


MORUSIN

An extended flavonoid that is flavone substituted by hydroxy groups at positions 5, 2' and 4', a prenyl group at position 3 and a 2,2-dimethyl pyran group across positions 7 and 8.


CUDRAFLAVONE B

An extended flavonoid that consists of a pyranochromane skeleton that is 2H,6H-pyrano[3,2-g]chromen-6-one substituted by geminal methyl groups at position 2, a 2,4-dihydroxyphenyl group at position 8, a hydroxy group at position 5 and a prenyl group at position 7. Isolated from Morus alba and Morus species it exhibits anti-inflammatory activity.


mupirocin

An alpha,beta-unsaturated ester resulting from the formal condensation of the alcoholic hydroxy group of 9-hydroxynonanoic acid with the carboxy group of (2E)-4-[(2S)-tetrahydro-2H-pyran-2-yl]-3-methylbut-2-enoic acid in which the tetrahydropyranyl ring is substituted at positions 3 and 4 by hydroxy groups and at position 5 by a {(2S,3S)-3-[(2S,3S)-3-hydroxybutan-2-yl]oxiran-2-yl}methyl group. Originally isolated from the Gram-negative bacterium Pseudomonas fluorescens, it is used as a topical antibiotic for the treatment of Gram-positive bacterial infections.


A diamine that is ethane-1,2-diamine in which both amino groups are substituted by diphenylmethyl groups. It is an allosteric agonist of the metabotropic glutamate receptor 7 (mGluR7).


ancitabine

An organic heterotricyclic compound resulting from the formal condensation of the oxo group of cytidine to the 2' position with loss of water to give the corresponding cyclic ether. A prodrug, it is metabolised to the antineoplastic agent cytarabine, so is used to maintain a more constant antineoplastic action.


name: 2,4-Cresotic acid, 6-anilino-, ethyl ester


name: 2-[2-(3,4-dihydro-2H-naphthalen-1-ylidene)hydrazinyl]-4-thiazolecarboxylic acid ethyl ester


linezolid

An organofluorine compound that consists of 1,3-oxazolidin-2-one bearing an N-3-fluoro-4-(morpholin-4-yl)phenyl group as well as an acetamidomethyl group at position 5. A synthetic antibacterial agent that inhibits bacterial protein synthesis by binding to a site on 23S ribosomal RNA of the 50S subunit and prevents further formation of a functional 70S initiation complex.


A member of the class of indoles that is 1H-indole substituted by a isopropyl group at position 5, a tert-butylsulfanediyl group at position 3, a 4-chlorobenzyl group at position 1 and a 2-carboxy-2-methylpropyl group at position 2. It acts as an inhibitor of  arachidonate 5-lipoxygenase.


name: 1-[2-(2,5-Dimethylanilino)-5-keto-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carbonyl]isonipecotic acid ethyl ester


name: Cyclobutanecarboxylic acid [1-[[4-(3,4-difluorophenyl)-2-thiazolyl]amino]-1-oxopropan-2-yl] ester


name: 2,2-Dichloro-1-methyl-1-cyclopropanecarboxylic acid [2-[[4-(3,4-difluorophenyl)-2-thiazolyl]amino]-2-oxoethyl] ester


name: 2-Chlorobenzoic acid [2-methoxy-4-[(vanilloylhydrazono)methyl]phenyl] ester


name: 2-(Veratroylamino)acetic acid 3-[2-(veratroylamino)acetyl]oxypropyl ester


name: 9-keto-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxylic acid o-veratryl ester


name: 2-[[4-(Methylthio)-3-nitro-phenyl]sulfonylamino]acetic acid [2-keto-2-(2-ketopyrrolidino)ethyl] ester


sphingosine

A sphing-4-enine in which the double bond is trans.


fusidic acid

A steroid antibiotic that is isolated from the fermentation broth of Fusidium coccineum.


cetrimonium

A quaternary ammonium ion in which the substituents on nitrogen are one hexadecyl and three methyl groups.


name: 6-methyl-4-(2-thienyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid isobutyl ester


tioxolone

A 1,3-benzoxathiole having a hydroxy substituent at the 6-position.


alexidine

An amphipathic bisbiguanide with a structure consisting of two (2-ethylhexyl)guanide units linked by a hexamethylene bridge.


name: DRTS_LEIMA Bifunctional dihydrofolate reductase-thymidylate synthase (sprot)

description: A protein that is a translation product of the LmjF06.0860 gene in Leishmania major.


name: CCNE1_HUMAN G1/S-specific cyclin-E1 (sprot)

description: A G1/S-specific cyclin-E1 that is encoded in the genome of human.


name: DLD_ECOLI Quinone-dependent D-lactate dehydrogenase (sprot)

description: A quinone-dependent D-lactate dehydrogenase that is encoded in the genome of Escherichia coli K-12.


name: DAPB_ECOLI 4-hydroxy-tetrahydrodipicolinate reductase (sprot)

description: A 4-hydroxy-tetrahydrodipicolinate reductase that is encoded in the genome of Escherichia coli K-12.


name: DXR_ECOLI 1-deoxy-D-xylulose 5-phosphate reductoisomerase (sprot)

description: A 1-deoxy-D-xylulose 5-phosphate reductoisomerase that is encoded in the genome of Escherichia coli K-12.


name: FA8_HUMAN Coagulation factor VIII (sprot)

description: A coagulation factor VIII that is encoded in the genome of human.


CALM1_HUMAN Calmodulin-1 (sprot)

A calmodulin (human) that is a translation product of the CALM1 gene.


name: TGM2_HUMAN Protein-glutamine gamma-glutamyltransferase 2 (sprot)

description: A protein-glutamine gamma-glutamyltransferase 2 that is encoded in the genome of human.


DEMETHYLBELLIDIFOLIN

A member of the class of xanthones that is xanthone which is substituted by hydroxy groups at positions 1, 3, 5, and 8. A natural product found particularly in Iris nigricans and Gentiana campestris.


BELLIDIFOLIN

A member of the xanthone family that is bellidin substituted with a methyl group at O-3.  A natural product found  particularly in Swertia chirata and Gentianella campestris.


A member of the class of  xanthones that is xanthone substituted by hydroxy groups at positions 1, 3 and 5. It has been isolated from Anaxagorea luzonensis.


name: SCAF_HHV11 Capsid scaffolding protein (sprot)


name: TPPP_HUMAN Tubulin polymerization-promoting protein (sprot)

description: A tubulin polymerization-promoting protein that is encoded in the genome of human.


name: 2-[[3-[3-(Homoveratrylamino)-3-keto-propyl]-4-keto-quinazolin-2-yl]thio]acetic acid ethyl ester


name: 1-Piperazineacetic acid, 4-methyl-, 2-(hydroxybis(4-methylphenyl)acetyl)hydrazide


name: 4,5-dimethyl-2-[[1-oxo-2-(4-quinazolinyloxy)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester


dirithromycin

The hemi-aminal resulting from the condensation of the erythromycin derivative (9S)-erythromycyclamine with 2-(2-methoxyethoxy)acetaldehyde. As the oxazine ring containing the hemi-aminal group is unstable under both acidic and alkaline conditions, dirithromycin functions as a more lipid-soluble prodrug for (9S)-erythromycyclamine. Administered as enteric coated tablets to protect it from acid catalysed hydrolysis in the stomach, it is used to treat respiratory tract, skin, and soft tissue infections caused by susceptible organisms.


name: 4-[[2-(3-Chlorophenyl)-5-methyl-4-oxazolyl]methyl]-5-thieno[3,2-b]pyrrolecarboxylic acid methyl ester


name: NOD1_HUMAN Nucleotide-binding oligomerization domain-containing protein 1 (sprot)

description: A nucleotide-binding oligomerization domain-containing protein 1 that is encoded in the genome of human.


name: 1-[(4-Acetyl-2-methyl-2,3-dihydro-1,4-benzothiazin-6-yl)sulfonyl]isonipecotic acid ethyl ester


naltrexone

An  organic heteropentacyclic compound that is naloxone substituted in which the allyl group attached to the nitrogen is replaced by a cyclopropylmethyl group. A mu-opioid receptor antagonist, it is used to treat alcohol dependence.


name: Benzoic acid, 4-chloro-, 2-(2H-1,4-benzothiazin-3-yl)hydrazide


name: 3-phenylpropanoic acid 2-(dimethylamino)ethyl ester


ethacrynic acid

An aromatic ether that is phenoxyacetic acid in which the phenyl ring is substituted by chlorines at positions 2 and 3, and by a 2-methylidenebutanoyl group at position 4. It is a loop diuretic used to treat high blood pressure resulting from diseases such as congestive heart failure, liver failure, and kidney failure. It is also a glutathione S-transferase (EC 2.5.1.18) inhibitor.


name: GPR55_HUMAN G-protein coupled receptor 55 (sprot)

description: A G-protein coupled receptor 55 that is encoded in the genome of human.


name: 1-naphthalenecarboxylic acid [[phenyl(2-pyridinyl)methylidene]amino] ester


NILE RED

An organic heterotetracyclic compound that is 5H-benzo[a]phenoxazin-5-one substituted at position 9 by a diethylamino group.


name: N-[(4S)-1-[(1S)-1-benzyl-2-(phenylthio)ethyl]-7-keto-azepan-4-yl]carbamic acid benzyl ester


name: N-[(4S)-1-[(1S)-1-benzyl-2-(p-tolylthio)ethyl]-7-keto-azepan-4-yl]carbamic acid benzyl ester


name: SAE1_HUMAN SUMO-activating enzyme subunit 1 (sprot)

description: A SUMO-activating enzyme subunit 1 that is encoded in the genome of human.


name: IF4H_HUMAN Eukaryotic translation initiation factor 4H (sprot)

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


name: Furan-2-carboxylic acid 1-[(furan-2-ylmethyl)-carbamoyl]-2-methyl-propyl ester


name: 4-(2-furyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid isopropyl ester


name: 4-(4-chlorophenyl)-4-oxobutanoic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester


name: [4-Bromo-2-(2-imino-4-oxo-thiazolidin-5-ylidenemethyl)-phenoxy]-acetic acid ethyl ester


name: 2-(4-Ethoxy-phenylcarbamoyl)-pyrrolidine-1-carboxylic acid phenyl ester


name: 3-(4-Methylpiperazino)sulfonylbenzoic acid p-cumenyl ester


name: 1-Benzyl-2-imino-10-oxo-1,10-dihydro-2H-1,9,10a-triaza-anthracene-3-carboxylic acid ethyl ester


name: 5-cyano-6-phenoxy-2-phenyl-3-pyridinecarboxylic acid ethyl ester


name: 4-(4-morpholinyl)-3-nitrobenzoic acid 2-[3-(cyanomethyl)-4-methyl-5-thiazol-3-iumyl]ethyl ester


name: PABP1_HUMAN Polyadenylate-binding protein 1 (sprot)

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


name: GPR35_HUMAN G-protein coupled receptor 35 (sprot)

description: A G-protein coupled receptor 35 that is encoded in the genome of human.


name: CAC1B_HUMAN Voltage-dependent N-type calcium channel subunit alpha-1B (sprot)

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


An organic heterobicyclic compound based on a fused 1,2-thiazole and benzene bicyclic ring skeleton, with the S atom positioned adjacent to one of the positions of ring fusion.


name: 4-{3-[5-(3-Methoxy-benzylidene)-4-oxo-2-thioxo-thiazolidin-3-yl]-propionyl}-piperazine-1-carboxylic acid ethyl ester


name: Acetic acid [4-[(benzo[e]benzofuran-2-carbonylhydrazono)methyl]phenyl] ester


HESPERIDIN

A disaccharide derivative that consists of hesperetin substituted by a 6-O-(alpha-L-rhamnopyranosyl)-beta-D-glucopyranosyl moiety at position 7 via a glycosidic linkage.


ISOKAEMPFERIDE

A trihydroxyflavone that is  apigenin substituted by a methoxy group at position 3.


A pentahydroxyflavone that is flavone substituted by hydroxy groups at positions 5, 6, 7, 8, and 4' respectively.


name: 2-[(3S)-1,1-diketo-2-(3-methoxyphenyl)-6-(trifluoromethyl)-3H-1,2-benzothiazol-3-yl]acetic acid ethyl ester


name: 3,4-Dimethoxybenzoic acid [2-[(5-nitro-2-thiazolyl)amino]-2-oxoethyl] ester


name: NPBW1_HUMAN Neuropeptides B/W receptor type 1 (sprot)

description: A neuropeptides B/W receptor type 1 that is encoded in the genome of human.


name: 2-[4-(5-acetyl-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl)-2-chloro-6-methoxyphenoxy]acetic acid ethyl ester


name: 5-[[(4-methoxyanilino)-sulfanylidenemethyl]amino]-1H-pyrazole-4-carboxylic acid ethyl ester


name: Pentanedioic acid cyclohexylcarbamoylmethyl-o-tolyl-amide pyridin-2-ylamide


thioflavin T cation

A benzothiazolium ion obtained by methylation of the thiazole nitrogen of 2-[4-(dimethylamino)phenyl]-6-methyl-1,3-benzothiazole; the cationic component of thioflavin T.


name: 2-(2-Naphthalenylthio)acetic acid [3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxopropyl] ester


name: TNFA_HUMAN Tumor necrosis factor (sprot)

description: A tumor necrosis factor that is encoded in the genome of human.


name: BZLF1_EBVB9 Lytic switch protein BZLF1 (sprot)

description: A protein that is a translation product of the BZLF1 gene in Human herpesvirus 4 strain B95-8.


name: 3-{4-[3-(3-Fluoro-phenyl)-ureido]-piperidine-1-sulfonyl}-benzoic acid methyl ester


name: 3-Methyl-2-benzo[g]benzofurancarboxylic acid [2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl] ester


name: 2-[2-(Benzo[1,3]dioxol-5-yloxy)-acetylamino]-4-methyl-thiazole-5-carboxylic acid ethyl ester


name: 5-Methoxy-3-methyl-2-benzofurancarboxylic acid [2-[2-methyl-5-(4-morpholinylsulfonyl)anilino]-2-oxoethyl] ester


name: 3-Methyl-2-benzofurancarboxylic acid [1-(4-acetamidoanilino)-1-oxopropan-2-yl] ester


name: EBNA1_EBVB9 Epstein-Barr nuclear antigen 1 (sprot)

description: A protein that is a translation product of the EBNA1 gene in Human herpesvirus 4 strain B95-8.


name: HSF1_MOUSE Heat shock factor protein 1 (sprot)

description: A heat shock factor protein 1 that is encoded in the genome of mouse.


name: 3-(2,3-Dihydro-benzo[1,4]dioxin-6-ylamino)-propionic acid methyl ester


name: 5-[[(3,4-dichloroanilino)-sulfanylidenemethyl]amino]-1H-pyrazole-4-carboxylic acid methyl ester


name: 2-(2-chloroanilino)-4-oxo-4-phenylbutanoic acid (2-oxo-2-thiophen-2-ylethyl) ester


name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-quinolinecarboxylic acid ethyl ester


name: 1-(2-fluorophenyl)-1-cyclopentanecarboxylic acid [2-oxo-2-(4-sulfamoylanilino)ethyl] ester


name: 2-oxo-1H-pyridine-3-carboxylic acid [2-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-oxoethyl] ester


ANISOMYCIN

An antibiotic isolated from various Streptomyces species. It interferes with protein and DNA synthesis by inhibiting peptidyl transferase or the 80S ribosome system.


tubercidin

An N-glycosylpyrrolopyrimidine that is adenosine in which the in the 5-membered ring that is not attached to the ribose moiety is replaced by a carbon. Tubercidin is produced in the culture broth of Streptomyces tubericidus.


name: 1-(4-Hydroxyphenyl)-3-methyl-4,6-dioxo-5-phenyl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid ethyl ester


name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-N-methylcarbamic acid tert-butyl ester


name: (3S)-2-(2-chloro-1-oxoethyl)-1,1-dimethyl-4,9-dihydro-3H-pyrido[3,4-b]indole-3-carboxylic acid methyl ester


name: PP1A_HUMAN Serine/threonine-protein phosphatase PP1-alpha catalytic subunit (sprot)

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


name: H0YDU8_HUMAN Serine/threonine-protein phosphatase (Fragment) (trembl)


name: 9,10-Secostrychnidin-10-oic acid, 2, 3-dihydro-4-nitro-2,3-dioxo-


name: 4-[(2-Cyanoacetyl)amino]benzoic acid [2-keto-2-[4-(p-phenetylcarbamoyl)anilino]ethyl] ester


cantharidin

A monoterpenoid with an epoxy-bridged cyclic dicarboxylic anhydride structure secreted by many species of blister beetle, and most notably by the Spanish fly, Lytta vesicatoria.  Natural toxin inhibitor of protein phosphatases 1 and 2A.


name: KCNQ2_RAT Potassium voltage-gated channel subfamily KQT member 2 (sprot)

description: A voltage-gated potassium channel subunit KCNQ2 that is encoded in the genome of rat.


name: 2-(2-Furyl)cinchoninic acid [2-keto-2-(o-anisoylamino)ethyl] ester


name: 2-(2-Furyl)cinchoninic acid [2-keto-1-methyl-2-(p-anisylamino)ethyl] ester


name: 2-(2-Furyl)cinchoninic acid [2-[1-(4-fluorophenyl)ethylamino]-2-keto-ethyl] ester


name: 2-(2-Furyl)cinchoninic acid [2-[(3-chlorobenzyl)amino]-2-keto-ethyl] ester


name: 2-(2-Furyl)cinchoninic acid [2-keto-2-[2-(2-methoxyphenyl)ethylamino]ethyl] ester


name: 2-(2-Furyl)cinchoninic acid [2-keto-2-[(2-methylbenzyl)amino]ethyl] ester


name: 2-(2-Furyl)cinchoninic acid [2-[(2,4-dimethoxybenzyl)amino]-2-keto-ethyl] ester


name: 2-(2-Furyl)cinchoninic acid (2-keto-2-o-anisyloxy-ethyl) ester


name: 2-(2-Furyl)cinchoninic acid [3-keto-3-(o-anisylamino)propyl] ester


name: 2-(2-Furyl)cinchoninic acid [3-keto-3-(p-anisylamino)propyl] ester


IL8_HUMAN Interleukin-8 (sprot)

An interleukin-8 that is encoded in the genome of human.


NOX1_HUMAN NADPH oxidase 1 (sprot)

An NADPH oxidase 1 that is encoded in the genome of human.


phenothiazine

The 10H-tautomer of phenothiazine.


name: KCNJ2_MOUSE Inward rectifier potassium channel 2 (sprot)

description: An inward rectifier potassium channel 2 that is encoded in the genome of mouse.


name: LUXA_VIBHA Alkanal monooxygenase alpha chain (sprot)


name: RL19A_YEAST Large ribosomal subunit protein eL19A (sprot)

description: A large ribosomal subunit protein eL19 that is encoded in the genome of yeast.


A member of the class of pyrazolopyrimidine that is pyrazolo[3,4-d]pyrimidin-4-amine bearing additional tert-butyl and 4-chlorophenyl substituents at positions 1 and 3 respectively. It is a potent ATP-competitive inhibitor of the Src family of protein tyrosine kinases.


name: 3-(1-Methyl-1H-indol-3-yl)-2-nitro-acrylic acid ethyl ester


cycloheximide

A dicarboximide that is 4-(2-hydroxyethyl)piperidine-2,6-dione in which one of the hydrogens attached to the carbon  bearing the hydroxy group is replaced by a 3,5-dimethyl-2-oxocyclohexyl group. It is an antibiotic produced by the bacterium Streptomyces griseus.


octhilinone

A member of the class of 1,2-thiazole that is 1,2-thiazol-3-one substituted on the nitrogen (position 2) by an octyl group. A fungicide and antibacterial agent, it is used for treatment of canker and other fungal and bacterial diseases in fruit trees. It is no longer approved for use within the European Union.


name: 1-azepanecarboxylic acid (7-chloro-4-quinolinyl) ester


name: MEP2_YEAST Ammonium transporter MEP2 (sprot)

description: A protein that is a translation product of the MEP2 gene in yeast.


name: AGP1_YEAST General amino acid permease AGP1 (sprot)

description: A protein that is a translation product of the AGP1 gene in yeast.


name: CISY2_YEAST Citrate synthase, peroxisomal (sprot)

description: A protein that is a translation product of the CIT2 gene in yeast.


name: AMPL_YEAST Vacuolar aminopeptidase 1 (sprot)

description: A protein that is a translation product of the APE1 gene in yeast.


diiodohydroxyquinoline

A monohydroxyquinoline that is quinolin-8-ol in which the hydrogens at positions 5 and 7 are replaced by iodine.  It is considered the drug of choice for treating asymptomatic or moderate forms of amoebiasis.


nitroxoline

A monohydroxyquinoline in which the hydroxy group is positioned at C-8 with a nitro group trans to it at C-5.


name: Benzenesulfonic acid [(5-isopropyl-4-keto-2-methyl-cyclohexa-2,5-dien-1-ylidene)amino] ester


ciclopirox

A cyclic hydroxamic acid that is 1-hydroxypyridin-2(1H)-one in which the hydrogens at positions 4 and 6 are substituted by methyl and cyclohexyl groups, respectively. A broad spectrum antigfungal agent, it also exhibits antibacterial activity against many Gram-positive and Gram-negative bacteria, and has anti-inflammatory properties. It is used a a topical treatment of fungal skin and nail infections.


PYRITHIONE

A  pyridinethione that is pyridine-2(1H)-thione in which the hydrogen attached to the nitrogen is replaced by a hydroxy group. It is a Zn(2+) ionophore; the zinc salt is used as an antifungal and antibacterial agent.


name: NR2E3_HUMAN Photoreceptor-specific nuclear receptor (sprot)

description: A photoreceptor-specific nuclear receptor that is encoded in the genome of human.


The (4R,5S)-isomer of dethiobiotin.


name: NCOR2_HUMAN Nuclear receptor corepressor 2 (sprot)

description: A nuclear receptor corepressor 2 that is encoded in the genome of human.


lissamine rhodamine anion

An anionic fluorescent dye derived from sulforhodamine.


name: 4-[3-(Benzofuran-2-carbonyl)-4-hydroxy-5-keto-1-(5-methylisoxazol-3-yl)-3-pyrrolin-2-yl]benzoic acid methyl ester


name: (E)-2-cyano-3-[4-(dimethylamino)phenyl]acrylic acid [2-keto-2-(m-anisylamino)ethyl] ester


name: B2L11_HUMAN Bcl-2-like protein 11 (sprot)

description: A Bcl-2-like protein 11 that is encoded in the genome of human.


A monochlorobenzene that is benzene substituted by (chloroacetyl){2-oxo-2-[(2-phenylethyl)amino]-1-(thiophen-2-yl)ethyl}amino, chloro and methoxy groups at positions 1, 3 and 4, respectively. It is a covalent inhibitor of glutathione peroxidase 4 (GPX4) that induces ferroptosis in cells.


name: Nicotinic acid 2-methoxy-4-(2-nitro-vinyl)-phenyl ester


N-oleoyldopamine

A fatty amide resulting from the formal condensation of the carboxy group of oleic acid with the amino group of dopamine. Synthesised in catecholaminergic neurons, it crosses the blood-brain barrier and might be considered as a carrier of dopamine into the brain. It is a  transient receptor potential vanilloid type 1 (TRPV1) receptor agonist.


APJ_HUMAN Apelin receptor (sprot)

An apelin receptor that is encoded in the genome of human.


name: Benzotriazol-1-yl-acetic acid 2-(3,4-dichloro-phenyl)-2-oxo-ethyl ester


name: Nicotinic acid 2-(3,4-dichloro-phenyl)-2-oxo-ethyl ester


name: 2-Oxo-2H-chromene-3-carboxylic acid 2-(3-nitro-phenyl)-2-oxo-ethyl ester


name: Benzenesulfonylamino-acetic acid 2-(3-nitro-phenyl)-2-oxo-ethyl ester


name: 5-(4-Chlorobenzoyl)-4-(4-methoxyphenyl)-2-pyrazoline-3-carboxylic acid methyl ester


name: 5-(4-Chlorobenzoyl)-4-phenyl-2-pyrazoline-3-carboxylic acid ethyl ester


name: Propionic acid, 3-phenyl-, 2-(3-nitrophenyl)-2-oxoethyl ester


name: 2-Oxo-2H-chromene-3-carboxylic acid 2-methoxy-4-(2-nitro-vinyl)-phenyl ester


name: 3-(Methylsulfamoyl)benzoic acid [2-keto-2-(4-piperidinosulfonylphenyl)ethyl] ester


disulfiram

An organic disulfide that results from the formal oxidative dimerisation of N,N-diethyldithiocarbamic acid.  A multi-enzyme inhibitor that is used in alcohol aversion therapy and also exhibits anticancer properties.


name: 2-Phenoxyacetic acid [2-keto-2-(4-piperidinosulfonylphenyl)ethyl] ester


name: 2-(4-Methoxyphenyl)acetic acid [2-keto-2-(4-piperidinosulfonylphenyl)ethyl] ester


name: GLD1_CAEEL Female germline-specific tumor suppressor gld-1 (sprot)

description: A protein that is a translation product of the gld-1 gene in worm.


fonsecin

A naphtho-gamma-pyrone that is 2,3-dihydro-4H-benzo[g]chromen-4-one bearing a methyl substituent at position 2, a methoxy substituent at position 6 and three hydroxy substituents at positions 2, 5 and 8.


PURPURIN

A trihydroxyanthraquinone derived from anthracene by substitution with oxo groups at C-9 and C-10 and with hydroxy groups at C-1, C-2 and C-4.


phloretin

A member of the class of dihydrochalcones that is dihydrochalcone substituted by hydroxy groups at positions 4, 2', 4' and 6'.


mitoxantrone

A dihydroxyanthraquinone that is 1,4-dihydroxy-9,10-anthraquinone which is substituted by 6-hydroxy-1,4-diazahexyl groups at positions 5 and 8.


PICEATANNOL

A stilbenol that is trans-stilbene in which one of the phenyl groups is substituted by hydroxy groups at positions 3 and 4, while the other phenyl group is substituted by hydroxy groups at positions 3 and 5.


demethoxycurcumin

A beta-diketone that is curcumin in which one of the methoxy groups is replaced by hydrogen. It is found in Curcuma zedoaria and Etlingera elatior.


GALUTEOLIN

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


name: DDIT3_MOUSE DNA damage-inducible transcript 3 protein (sprot)

description: A DNA damage-inducible transcript 3 protein that is encoded in the genome of mouse.


name: 5-[(cyclohexylamino)-oxomethyl]-4-methyl-2-[(1-oxo-2-thiophen-2-ylethyl)amino]-3-thiophenecarboxylic acid ethyl ester


name: N-[(1S)-3-methyl-1-[[(2-methyl-2H-chromen-3-yl)methyleneamino]carbamoyl]butyl]carbamic acid tert-butyl ester


name: 4-tert-butylcyclohexanecarboxylic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester


name: [2,2,2-Trichloro-1-(3-m-tolyl-thioureido)-ethyl]-carbamic acid benzyl ester


name: 2-{4-[3-(2,4-Dichloro-benzoyl)-thioureido]-3-methyl-phenyl}-3,3,3-trifluoro-2-hydroxy-propionic acid methyl ester


name: [6-Bromo-2-(4-hydroxy-phenyl)-4-phenyl-1,4-dihydro-2H-quinazolin-3-yl]-acetic acid ethyl ester


name: 2-(3,5-dimethyl-1-pyrazolyl)-4-(4-hydroxyanilino)-5-pyrimidinecarboxylic acid ethyl ester


name: (2S)-2-[[5-[(2-tert-butoxy-2-keto-ethyl)carbamoyl]-1H-imidazole-4-carbonyl]amino]-4-methyl-valeric acid benzyl ester


name: GLF_MYCTU UDP-galactopyranose mutase (sprot)

description: A UDP-galactopyranose mutase that is encoded in the genome of Mycobacterium tuberculosis H37Rv.


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


CP1B1_HUMAN Cytochrome P450 1B1 (sprot)

A cytochrome P450 1B1 that is encoded in the genome of human.


progesterone

A C21-steroid hormone in which a pregnane skeleton carries oxo substituents at positions 3 and 20 and is unsaturated at C(4)-C(5). As a hormone, it is involved in the female menstrual cycle, pregnancy and embryogenesis of humans and other species.


name: 1-(4-Amino-furazan-3-yl)-5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1H-[1,2,3]triazole-4-carboxylic acid ethyl ester


name: benzoic acid [3,4-dihydroxy-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-oxolanyl]methyl ester


name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(2-pyridinylthio)methyl]-4-triazolecarboxylic acid propan-2-yl ester


name: 7-(2,3-Dimethoxyphenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid butyl ester


name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-4-triazolecarboxylic acid ethyl ester


name: 7-(5-Bromo-2-fluorophenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester


name: 6-Ethoxy-4-(4-methylpiperazino)quinoline-3-carboxylic acid ethyl ester;hydrochloride


name: 7-(1H-indol-3-yl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester


name: 7-(1H-indol-3-yl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid isopropyl ester


name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(phenoxymethyl)-4-triazolecarboxylic acid ethyl ester


name: 2-[2-(5-Isopropyl-4-methyl-4H-[1,2,4]triazol-3-ylsulfanyl)-acetylamino]-4-methyl-thiazole-5-carboxylic acid ethyl ester


name: 5-Methyl-7-(2-thienyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester


name: Chloro-acetic acid 3-(thiophene-2-carbonyl)-benzofuran-5-yl ester


name: 4-(2,3-Dihydro-benzo[1,4]dioxin-6-ylamino)-quinoline-3,6-dicarboxylic acid 3-ethyl ester 6-methyl ester


A cationic C3 cyanine-type compound with 4-(dimethylamino)phenyl and 3-ethyl-1,3-benzothiazolium groups at either end.


name: 5-Propyl-7-(2-thienyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester


name: 7-(2-Furanyl)-5-propyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester


stephanthrine

An organic heterotetracyclic compound that is 2-(2H-phenanthro[3,4-d][1,3]dioxole in which the hydrogen at position 5 has been replaced by a 2-(dimethylamino)ethyl group.


rutoside

A rutinoside that is quercetin with the hydroxy group at position C-3 substituted with glucose and rhamnose sugar groups.


name: 4-Methoxybenzoic acid 2-(4-methyl-3-phenacyl-5-thiazol-3-iumyl)ethyl ester;bromide


name: KLF5_HUMAN Krueppel-like factor 5 (sprot)

description: A krueppel-like factor 5 that is encoded in the genome of human.


RECA_MYCTU Protein RecA (sprot)

A protein that is a translation product of the recA gene in Mycobacterium tuberculosis H37Rv.


name: Furan-2-carboxylic acid 4-tetrazol-1-yl-phenyl ester


name: [5-(2-Bromo-phenyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-acetic acid 3-methoxy-phenyl ester


name: 2-(3,4-dimethyl-6-oxo-2H-pyrano[2,3-c]pyrazol-5-yl)acetic acid ethyl ester


diloxanide furoate

A carboxylic ester resulting from the formal condensation of the carboxy group of furan-2-carboxylic acid with the hydroxy group of 2,2-dichloro-N-(4-hydroxyphenyl)-N-methylacetamide. It is a drug used for the treatment of asymptomatic amebiasis.


name: Furan-2-carboxylic acid (2-succinimidophenyl) ester


name: Cyclopropanecarboxylic acid [5-(6-amino-5-cyano-3-methyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)-2-ethoxy-phenyl] ester


name: N-[2-[5-[(2,4-dichlorophenyl)methylsulfonyl]-1,3,4-oxadiazol-2-yl]ethyl]carbamic acid tert-butyl ester


name: 4-Morpholinecarboxylic acid [4-(6-amino-5-cyano-3-propyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)-2-methoxyphenyl] ester


name: 2-[[3-(4-fluorophenyl)-7-triazolo[4,5-d]pyrimidinyl]thio]butanoic acid ethyl ester


name: 4-Morpholinecarboxylic acid [3-[6-amino-5-cyano-3-(4-fluorophenyl)-2,4-dihydropyrano[2,3-c]pyrazol-4-yl]phenyl] ester


name: 2-[[4-cyano-3-[(2-methoxy-2-oxoethyl)thio]-5-isothiazolyl]thio]acetic acid ethenyl ester


name: 4-Morpholinecarboxylic acid [2-[6-amino-5-cyano-3-(4-methoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazol-4-yl]phenyl] ester


name: Furan-2-carboxylic acid [4-(6-amino-5-cyano-3-isopropyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl] ester


name: 2-Furancarboxylic acid [3-(6-amino-5-cyano-3-propyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl] ester


name: Morpholine-4-carboxylic acid [3-(6-amino-5-cyano-3-isopropyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl] ester


name: 2-(3-oxo-2-phenyl-1H-pyrazol-5-yl)acetic acid methyl ester


name: 2-[6-Amino-5-cyano-4-(3-furanyl)-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]acetic acid ethyl ester


name: Furan-2-carboxylic acid (4-succinimidophenyl) ester


name: 2-Furancarboxylic acid [4-(6-amino-5-cyano-3-propyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl] ester


REV_HV1H2 Protein Rev (sprot)

A protein that is a translation product of the rev gene in human immunodeficiency virus type 1 group M subtype B (isolate HXB2).


name: (4-Benzyl-5-furan-2-yl-4H-[1,2,4]triazol-3-ylsulfanyl)-acetic acid cyclohexyl ester


name: 2-[2-(3-ethylphenoxy)ethyl]propanedioic acid diethyl ester


A 2-hydroxy steroid that consists of 17beta-estradiol having an additional hydroxy group at position 2.


name: (E)-4-anilino-3-cyano-2-oxo-3-butenoic acid ethyl ester


name: 4-(2,3-Dihydro-indol-1-yl)-4-oxo-but-2-enoic acid ethyl ester


name: p-Tolyl-carbamic acid 2-[2-(4-chloro-phenyl)-4-oxo-thiazolidin-3-yl]-butyl ester


name: 3-[[4-Chloro-2-keto-5-[(o-tolylhydrazono)methyl]-4-thiazolin-3-yl]methyl]benzoic acid methyl ester


name: thiocyanic acid [4-[(2-chloro-1-oxoethyl)amino]-3,5-dimethylphenyl] ester


name: 2-[[5-(dimethylsulfamoyl)-1H-indol-3-yl]methylidene]propanedioic acid diethyl ester


name: [[2-[(4,5-dimethyl-2-thiazolyl)amino]-2-oxoethyl]thio]methanethioic acid O-ethyl ester


name: 2-Methylbenzoic acid [(2-amino-1-diisopropoxyphosphoryl-2-keto-ethylidene)amino] ester


name: 4-[(E)-2-(2-methoxyphenyl)ethenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid bis(2-methoxyethyl) ester


aminoacridine

Acridines which are substituted in any position by one or more amino groups or substituted amino groups. Note that the term 'aminoacridine' is the International Prorietary Name (INN) for 9-aminoacridine.


name: 1-(9-Chloro-5,6,7,8-tetrahydroacridine-3-carbonyl)isonipecotic acid ethyl ester


name: 3-(4-Ethoxyphenoxy)propionic acid [2-[4-(4-chlorophenyl)sulfonylpiperazino]-2-keto-ethyl] ester


name: (3S)-3-cyclopentyl-4-oxo-3-phenyldiazetidine-1,2-dicarboxylic acid dimethyl ester


name: CY24B_HUMAN Cytochrome b-245 heavy chain (sprot)

description: A cytochrome b-245 heavy chain that is encoded in the genome of human.


acetylcholine

Actylcholine is an ester of acetic acid and choline, which acts as a neurotransmitter.


name: KCNJ3_RAT G protein-activated inward rectifier potassium channel 1 (sprot)

description: A G protein-activated inward rectifier potassium channel 1 that is encoded in the genome of rat.


name: KCNJ1_HUMAN ATP-sensitive inward rectifier potassium channel 1 (sprot)

description: An ATP-sensitive inward rectifier potassium channel 1 that is encoded in the genome of human.


LANA1_HHV8P Protein LANA1 (sprot)

A protein that is a translation product of the ORF73 gene in Human herpesvirus 8 strain GK18.


name: 4-Cyclohex-3-en-1-yl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester


A cationic fluorescent dye derived from 9-phenylxanthene.


name: IMA1_HUMAN Importin subunit alpha-1 (sprot)

description: An importin subunit alpha-1 that is encoded in the genome of human.


name: 2-[[4-cyano-6,6,7-trimethyl-1-(4-morpholinyl)-5,8-dihydro-2,7-naphthyridin-3-yl]thio]acetic acid methyl ester


name: 5-Keto-2,7,7-trimethyl-4-(3-pyridyl)-1,4,6,8-tetrahydroquinoline-3-carboxylic acid isopropyl ester


name: 2-(1-Benzoylamino-2,2,2-trifluoro-1-trifluoromethyl-ethylamino)-6-methyl-4,5,6,7-tetrahydro-thieno[2,3-c] pyridine-3-carboxylic acid methyl ester


ACRIDONE

A member of the class of  acridines that is 9,10-dihydroacridine substituted by an oxo group at position 9.


name: Phenyl-(toluene-4-sulfonylamino)-acetic acid 2-oxo-2H-chromen-7-yl ester


name: 4-(4-chlorophenyl)-1-(2-methoxyethyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester


name: 1-cyclopropyl-4-[4-(trifluoromethyl)phenyl]-4H-pyridine-3,5-dicarboxylic acid dimethyl ester


name: 4-(3-hydroxyphenyl)-1-(2-oxolanylmethyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester


name: 2-[7-Hydroxy-2-keto-4-methyl-8-[(veratrylamino)methyl]chromen-3-yl]acetic acid methyl ester;hydrochloride


A hydroxycoumarin that is coumarin substituted by a methyl group at position 4, a hydroxy group at position 7 and a p-methoxyphenyl group at position 3 respectively.


name: GSTO1_HUMAN Glutathione S-transferase omega-1 (sprot)

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


name: AHR_HUMAN Aryl hydrocarbon receptor (sprot)

description: An aryl hydrocarbon receptor that is encoded in the genome of human.


name: 2-(2-Imidazol-1-yl-acetylamino)-benzoic acid methyl ester


name: 3-methoxybenzoic acid [[amino-(4-nitrophenyl)methylidene]amino] ester


CSC

Caffeine substituted at its 8-position by an (E)-3-chlorostyryl group.


OXYR_HUMAN Oxytocin receptor (sprot)

An oxytocin receptor that is encoded in the genome of human.


name: PPBI_HUMAN Intestinal-type alkaline phosphatase (sprot)

description: An intestinal alkaline phosphatase that is encoded in the genome of human.


name: 4-[[4-(isoxazol-3-ylcarbamoyl)-1H-imidazole-5-carbonyl]amino]piperidine-1-carboxylic acid tert-butyl ester


name: PPME1_HUMAN Protein phosphatase methylesterase 1 (sprot)

description: A protein phosphatase methylesterase 1 that is encoded in the genome of human.


QUERCETIN GLUCURONIDE

A quercetin O-glycoside that consists of quercetin attached to a beta-D-glucuronopyranosyl moiety at position 3 via a glycosidic linkage. Isolated from Salvia and Phaseolus vulgaris, it exhibits antioxidant and antidepressant activities.


MANGIFERIN

A C-glycosyl compound consisting of 1,3,6,7-tetrahydroxyxanthen-9-one having a beta-D-glucosyl residue at the 6-position.


FURIN_HUMAN Furin (sprot)

A furin that is encoded in the genome of human.


name: AGTR1_HUMAN Type-1 angiotensin II receptor (sprot)

description: An angiotensin II receptor 1 that is encoded in the genome of human.


name: 3-Acetamidobenzoic acid [2-keto-2-(4-piperidinosulfonylphenyl)ethyl] ester


name: IDE_HUMAN Insulin-degrading enzyme (sprot)

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


name: (E)-2-cyano-3-[4-(dimethylamino)phenyl]acrylic acid [2-[benzyl(methyl)amino]-2-keto-1-methyl-ethyl] ester


name: (E)-2-cyano-3-[4-(dimethylamino)phenyl]acrylic acid [2-keto-1-methyl-2-(N-methylanilino)ethyl] ester


bisphenol F

A bisphenol that is methane in which two of the hydrogens have been replaced by 4-hydroxyphenyl groups.


name: PPBI1_RAT Intestinal-type alkaline phosphatase 1 (sprot)

description: An intestinal alkaline phosphatase that is encoded in the genome of rat.


phenylalanine betaine

An amino acid betaine derived from phenylalanine.


catechin

The (+)-enantiomer of catechin and a polyphenolic antioxidant plant metabolite.


ALOE-EMODIN

A dihydroxyanthraquinone that is  chrysazin carrying a hydroxymethyl group at position 3. It has been isolated from plant species of the genus Aloe.


name: 4-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]benzoic acid methyl ester


(-)-Epicatechin

A catechin with (2R,3R)-configuration.


CALMIDAZOLIUM

An  imidazolium ion that is imidazolium cation substituted by a bis(4-chlorophenyl)methyl group at position 1 and a 2-[(2,4-dichlorobenzyl)oxy]-2-(2,4-dichlorophenyl)ethyl group at position 3. It acts as an antagonist of calmodulin, a calcium binding messenger protein.


name: NLRP3_HUMAN NACHT, LRR and PYD domains-containing protein 3 (sprot)

description: A NACHT, LRR and PYD domains-containing protein 3 that is encoded in the genome of human.


chlorquinaldol

A monohydroxyquinoline that is quinolin-8-ol which is substituted by a methyl group at position 2 and by chlorine at positions 5 and 7. An antifungal and antibacterial, it was formerly used for topical treatment of skin conditions and vaginal infections.


name: 1-[2-Furfuryl(picolinoyl)amino]cyclohexanecarboxylic acid isopropyl ester


name: NLRP1_HUMAN NACHT, LRR and PYD domains-containing protein 1 (sprot)

description: A NACHT, LRR and PYD domains-containing protein 1 that is encoded in the genome of human.


name: 2-[4-[(E)-[[4-[2-(4-chloroanilino)thiazol-4-yl]benzoyl]hydrazono]methyl]phenoxy]acetic acid ethyl ester


name: DNM3A_HUMAN DNA (cytosine-5)-methyltransferase 3A (sprot)

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


ipriflavone

A member of the class of isoflavones that is isoflavone in which the hydrogen at position 7 is replaced by an isopropoxy group. A synthetic isoflavone, it was formerly used for the treatment of osteoporosis, although a randomised controlled study failed to show any benefit. It is still used to prevent osteoporosis in post-menopausal women.


name: 3-[[(2,4-dinitrophenyl)-oxomethyl]amino]benzoic acid [2-(4-methylphenyl)-2-oxoethyl] ester


name: 4-chlorobenzoic acid [1-(2-thiazolyl)ethylideneamino] ester


name: 4-fluorobenzoic acid (3,4-dihydro-2H-naphthalen-1-ylideneamino) ester


name: 5-nitro-2-thiophenecarboxylic acid [2-oxo-2-[(phenylmethyl)amino]ethyl] ester


An organic cation that is the conjugate acid of (R)-glaucine, obtained by protonation of the tertiary amino group; major species at pH 7.3.


name: 2-[4-(difluoromethylthio)anilino]benzoic acid [2-(dimethylamino)-2-oxoethyl] ester


name: 4-(2-quinoxalinylamino)benzoic acid ethyl ester


name: 5-nitro-2-thiophenecarboxylic acid [2-oxo-2-[[oxo-[(phenylmethyl)amino]methyl]amino]ethyl] ester


A dihydroxyflavone that is flavone substituted by hydroxy groups at positions 4' and 6.


name: N-[2-(1-azepanyl)-1,3-benzothiazol-6-yl]carbamic acid ethyl ester


name: (E)-3-(9-ketoxanthen-2-yl)acrylic acid ethyl ester


name: 2-(p-Tolyl)-2-(quinazolin-4-ylhydrazono)acetic acid ethyl ester


name: 2-keto-4-methyl-6-[(5-nitrothiophene-2-carbonyl)oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester


name: SENP8_HUMAN Sentrin-specific protease 8 (sprot)

description: A sentrin-specific protease 8 that is encoded in the genome of human.


DIHYDROXANTHOHUMOL

A member of the class of dihydrochalcones that is the alpha,beta-dihydro derivative of xanthohumol. Isolated from Humulus lupulus, it exhibits inhibition of NO production.


name: SENP6_HUMAN Sentrin-specific protease 6 (sprot)

description: A sentrin-specific protease 6 that is encoded in the genome of human.


name: CAC1H_HUMAN 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 human.


name: {5-[(3-Chloro-phenylamino)-methyl]-4-methyl-4H-[1,2,4]triazol-3-ylsulfanyl}-acetic acid cyclohexyl ester


oxatomide

A member of the class of benzimidazoles that is 1,3-dihydro-2H-benzimidazol-2-one substituted by a 3-[4-(diphenylmethyl)piperazin-1-yl]propyl group at position 1. It is an anti-allergic drug.


name: (1H-Indol-3-yl)-acetic acid 2-(2-1H-indol-3-yl-acetoxy)-ethyl ester


name: {2-[2-(Naphthalen-2-yloxy)-acetylamino]-thiazol-4-yl}-acetic acid ethyl ester


name: (E)-2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]thio]-3-[2-(trifluoromethyl)anilino]acrylic acid ethyl ester


name: 3-(Azepane-1-sulfonyl)-4-methyl-benzoic acid 4-nitro-phenyl ester


sulfamethoxazole

An isoxazole (1,2-oxazole) compound having a methyl substituent at the 5-position and a 4-aminobenzenesulfonamido group at the 3-position.


name: RECD_ECOLI RecBCD enzyme subunit RecD (sprot)

description: A RecBCD enzyme subunit RecD that is encoded in the genome of Escherichia coli K-12.


trifluridine

A pyrimidine 2'-deoxyribonucleoside compound having 5-trifluoromethyluracil as the nucleobase. An antiviral drug used mainly in the treatment of primary keratoconjunctivitis and recurrent epithelial keratitis.


name: PADI4_HUMAN Protein-arginine deiminase type-4 (sprot)

description: A protein-arginine deiminase type-4 that is encoded in the genome of human.


TPCK

The N-tosyl derivative of L-phenylalanyl chloromethyl ketone.


name: TRPC4_MOUSE Short transient receptor potential channel 4 (sprot)

description: A short transient receptor potential cation channel TRPC4 that is encoded in the genome of mouse.


name: TIM10_YEAST Mitochondrial import inner membrane translocase subunit TIM10 (sprot)

description: A mitochondrial import inner membrane translocase subunit Tim10 that is encoded in the genome of yeast.


name: [5-(4-Chloro-phenylamino)-2-oxa-1,3,4,6,7,8a-hexaaza-as-indacen-8-yl]-acetic acid ethyl ester


clomipramine

A dibenzoazepine that is 10,11-dihydro-5H-dibenzo[b,f]azepine which is substituted by chlorine at position 3 and in which the hydrogen attached to the nitrogen is replaced by a 3-(dimethylamino)propyl group. One of the more sedating tricyclic antidepressants, it is used as the hydrochloride salt for the treatment of depression as well as obsessive-compulsive disorder and phobias.


name: 1-[2,5-Diketo-1-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl]nipecotic acid ethyl ester;hydrochloride


name: 4-[[2-(4-ethyl-3-oxo-2-morpholinyl)-1-oxoethyl]amino]benzoic acid ethyl ester


name: 4-[3-[Homoveratryl(methyl)amino]-2,5-diketo-pyrrolidino]benzoic acid methyl ester


name: 1-[1-(4-Carbethoxyphenyl)-2,5-diketo-pyrrolidin-3-yl]isonipecotic acid ethyl ester


name: 1-[1-(3-Chlorophenyl)-2,5-diketo-pyrrolidin-3-yl]isonipecotic acid ethyl ester


name: 4-[3-[4-(4-Fluoroanilino)piperidino]-2,5-diketo-pyrrolidino]benzoic acid ethyl ester


name: piperonylic acid [(Z)-[amino(p-tolyl)methylene]amino] ester


name: Thiophene-3-carboxylic acid, 2-(((methylamino)thioxomethyl)amino)-4-phenyl-, ethyl ester


name: 3-cyclopentylpropanoic acid [[amino(phenyl)methylidene]amino] ester


name: 6,7,8,9-Tetrahydro-5H-carbazole-3-carboxylic acid ethyl ester


name: 4-[[3-Keto-2-(tetrahydrofurfuryl)isoindoline-4-carbonyl]amino]benzoic acid ethyl ester


name: 1-(9-Hydroxy-1-methyl-spiro[8,9-dihydrofuro[3,2-f]chromene-7,1''-cyclohexane]-2-carbonyl)isonipecotic acid ethyl ester


fluphenazine

A member of the class of phenothiazines that is 10H-phenothiazine having a trifluoromethyl subsitituent at the 2-position and a 3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl group at the N-10 position.


thiethylperazine

A member of the class of phenothiazines that is perazine substituted by a ethylsulfanyl group at position 2.


name: 4-hydroximino-1,3-dimethyl-6,7-dihydro-5H-indole-2-carboxylic acid ethyl ester


name: UBE2N_HUMAN Ubiquitin-conjugating enzyme E2 N (sprot)

description: A ubiquitin-conjugating enzyme E2 N that is encoded in the genome of human.


perphenazine

A phenothiazine derivative in which the phenothiazine tricycle carries a chloro substituent at the 2-position and a 3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl group at N-10.


naringin

A disaccharide derivative that is (S)-naringenin substituted by a 2-O-(alpha-L-rhamnopyranosyl)-beta-D-glucopyranosyl moiety at position 7 via a glycosidic linkage.


spermine

A polyazaalkane that is tetradecane in which the carbons at positions 1, 5, 10 and 14 are replaced by nitrogens. Spermine has broad actions on cellular metabolism.


name: XBP1_HUMAN X-box-binding protein 1 (sprot)

description: An X-box-binding protein 1 that is encoded in the genome of human.


name: (4-Chloro-phenyl)-carbamic acid 2-(4-oxo-2-p-tolyl-thiazolidin-3-yl)-butyl ester


name: 2,6-dimethyl-4-[(E)-styryl]-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester


name: 2,6-dimethyl-4-[(E)-styryl]-1,4-dihydropyridine-3,5-dicarboxylic acid diallyl ester


name: [4-(3-Nitro-phenylsulfamoyl)-phenyl]-carbamic acid hexyl ester


name: 2-(2,6-dichlorophenyl)acetic acid [2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl] ester


name: 2-(4-methylsulfonyl-2-nitrophenyl)sulfinylacetic acid (phenylmethyl) ester


name: 2-[[[4-[(4-chloroanilino)-oxomethyl]-1H-imidazol-5-yl]-oxomethyl]amino]acetic acid tert-butyl ester


PLIN1_HUMAN Perilipin-1 (sprot)

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


mecysteine

An L-cysteinyl ester resulting from the formal condensation of the carboxylic acid group of L-cysteine with methanol. It is used (as the hydrochloride salt) as a mucolytic for the treatment of respiratory disorders associated with productive cough.


PLIN5_HUMAN Perilipin-5 (sprot)

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


inamrinone

A 3,4'-bipyridine substituted at positions 5 and 6 by an amino group and a keto function respectively. A pyridine phosphodiesterase 3 inhibitor, it is a drug that may improve the prognosis in patients with congestive heart failure.


name: ARBK1_HUMAN Beta-adrenergic receptor kinase 1 (sprot)

description: A beta-adrenergic receptor kinase 1 that is encoded in the genome of human.


name: TIM23_YEAST Mitochondrial import inner membrane translocase subunit TIM23 (sprot)

description: A mitochondrial import inner membrane translocase subunit Tim23 that is encoded in the genome of yeast.


name: NTR1_HUMAN Neurotensin receptor type 1 (sprot)

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


name: 2-fluorobenzoic acid [2-[(Z)-3-(2-benzofuranyl)-3-oxoprop-1-enyl]phenyl] ester


LASALOCID A SODIUM

The sodium salt of lasalocid. It is a veterinary ionophore antibiotic used for prevention and treatment of coccidiosis in poultry.


ITAL_MOUSE Integrin alpha-L (sprot)

An integrin alpha-L that is encoded in the genome of mouse.


name: 1-[3-[(3,4-Difluorophenyl)carbamoyl]-4-fluoro-phenyl]sulfonylnipecotic acid ethyl ester


HINOKITIOL

A monoterpenoid that is cyclohepta-2,4,6-trien-1-one substituted by a hydroxy group at position 2 and an isopropyl group at position 4. Isolated from Thuja plicata and Chamaecyparis obtusa, it exhibits antimicrobial activities.


name: 2-[(4-oxo-2-pyrido[1,2-a]pyrimidinyl)methylthio]-3-pyridinecarboxylic acid propan-2-yl ester


name: BARD1_HUMAN BRCA1-associated RING domain protein 1 (sprot)

description: A BRCA1-associated RING domain protein 1 that is encoded in the genome of human.


name: TPM1_PIG Tropomyosin alpha-1 chain (sprot)


name: Benzofuran-2-carboxylic acid 4-(benzooxazol-2-ylsulfanyl)-but-2-ynyl ester


name: (2S)-3-(1H-indol-3-yl)-2-(2-thenoylamino)propionic acid [2-keto-2-(p-anisylamino)ethyl] ester


name: 3-Methyl-2-benzo[g]benzofurancarboxylic acid [2-[2-(2,4-dioxo-3-thiazolidinyl)ethylamino]-2-oxoethyl] ester


name: Benzenesulfonic acid 2-bromo-6-ethoxy-4-(morpholine-4-carbothioyl)-phenyl ester


name: 2-keto-6-[[(E)-3-(3-methoxyphenyl)acryloyl]oxymethyl]-4-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester


name: 1H-indole-4-carboxylic acid 4-[[5-(1-naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester


name: ABC3G_HUMAN DNA dC->dU-editing enzyme APOBEC-3G (sprot)

description: A DNA dC->dU-editing enzyme APOBEC-3G that is encoded in the genome of human.


name: 4-[[2-(6-Ketothiazolo[3,2-b][1,2,4]triazol-5-yl)acetyl]amino]benzoic acid ethyl ester


name: 5-[diethylamino(oxo)methyl]-4-methyl-2-(1-oxopentylamino)-3-thiophenecarboxylic acid methyl ester


name: 2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)thio]propanoic acid methyl ester


name: 4-Methyl-2-[2-(phenylmethylene)hydrazinyl]-5-thiazolecarboxylic acid ethyl ester


aldrithiol

A member of the class of pyridines that is pyridine which is substituted by a pyridin-2-yldisulfanediyl group at position 2. It is a reagent used in molecular biology as an oxidizing agent. Also used in peptide synthesis and for detecting thiols.


name: 5'-Guanidinonaltrindole di(trifluoroacetate) salt hydrate, hydrochloride


name: ABC3A_HUMAN DNA dC->dU-editing enzyme APOBEC-3A (sprot)

description: A DNA dC->dU-editing enzyme APOBEC-3A that is encoded in the genome of human.


name: 3-pyridinecarboxylic acid (3-acetyl-4-oxido-2-quinoxalin-4-iumyl)methyl ester


trimethylphenylammonium

A quaternary ammonium ion obtained by methylation of N,N-dimethylaniline.


name: 1-(2-Naphthalen-1-yl-acetyl)-piperidine-4-carboxylic acid ethyl ester


name: 1-Phenylcyclopentanecarboxylic acid 3-(4-methylmorpholin-4-ium-4-yl)propyl ester;iodide


name: 2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetic acid (7-acetamido-2-oxo-1-benzopyran-4-yl)methyl ester


name: 3-Hydroxy-1-methyl-quinuclidinium iodide 2-hydroxymethyl-2-phenyl butyrate (ester)


name: 6-[[(E)-3-(2-furyl)acryloyl]oxymethyl]-2-keto-4-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester


name: 4-Fluoro-3-morpholinosulfonyl-benzoic acid [2-keto-2-[(2-keto-1,3-dihydrobenzimidazol-5-yl)amino]ethyl] ester


name: CCR6_HUMAN C-C chemokine receptor type 6 (sprot)

description: A C-C chemokine receptor type 6 that is encoded in the genome of human.


name: 2-(1-Butyryl-2,2-dimethyl-3-thioxo-2,3-dihydro-1H-quinolin-4-ylidene)-[1,3]dithiole-4,5-dicarboxylic acid dimethyl ester


name: 3-pyridinecarboxylic acid (5-chloro-8-quinolinyl) ester


HKDC1_HUMAN Hexokinase HKDC1 (sprot)

A hexokinase HKDC1 that is encoded in the genome of human.


SENNOSIDE B

A member of the class of sennosides that is (9R,9'S)-9,9',10,10'-tetrahydro-9,9'-bianthracene-2,2'-dicarboxylic acid which is substituted by hydroxy groups at positions 4 and 4', by beta-D-glucopyranosyloxy groups at positions 5 and 5', and by oxo groups at positions 10 and 10'.


name: 4-[(2,5-dihydroxyphenyl)methylamino]benzoic acid methyl ester


name: 2-Acetylamino-5-benzyl-4-methyl-thiophene-3-carboxylic acid methyl ester


name: ATG4B_HUMAN Cysteine protease ATG4B (sprot)

description: A cysteine protease ATG4B that is encoded in the genome of human.


name: 4-Morpholinecarboxylic acid [4-[6-amino-5-cyano-3-(4-methoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazol-4-yl]phenyl] ester


bifonazole

A racemate comprising equimolar amounts of R- and S-bifonazole. It is a broad spectrum antifungal drug used for the treatment of fungal skin and nail infections.


α-linolenic acid

A linolenic acid with cis-double bonds at positions 9, 12 and 15. Shown to have an antithrombotic effect.


fenticlor

An aryl sulfide having two 5-chloro-2-hydroxyphenyl groups attached to sulfur; an antiinfective drug mostly used in veterinary medicine.


HXK1_HUMAN Hexokinase-1 (sprot)

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


name: G6PD_HUMAN Glucose-6-phosphate 1-dehydrogenase (sprot)

description: A glucose-6-phosphate 1-dehydrogenase that is encoded in the genome of human.


name: KAP0_BOVIN cAMP-dependent protein kinase type I-alpha regulatory subunit (sprot)

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


3',5'-cyclic AMP(1-)

An organophosphate oxoanion that is the conjugate base of 3',5'-cyclic AMP arising from deprotonation of the free phosphate OH group; major species at pH 7.3.


name: 8-Bromoadenosine 3',5'-cyclic monophosphate sodium salt


name: KAP3_HUMAN cAMP-dependent protein kinase type II-beta regulatory subunit (sprot)

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


MGLL_RAT Monoglyceride lipase (sprot)

A monoglyceride lipase that is encoded in the genome of rat.


rottlerin

A chromenol that is 2,2-dimethyl-2H-chromene substituted by hydroxy groups at positions 5 and 7, a 3-acetyl-2,4,6-trihydroxy-5-methylbenzyl group at position 6 and a (1E)-3-oxo-1-phenylprop-1-en-3-yl group at position 8. A potassium channel opener, it is isolated from Mallotus philippensis.


name: Q504U8_HUMAN Receptor protein-tyrosine kinase (trembl)


LAPACHONE

A benzochromenone that is 3,4-dihydro-2H-benzo[h]chromene-5,6-dione substituted by geminal methyl groups at position 2. Isolated from Tabebuia avellanedae, it exhibits antineoplastic and anti-inflammatory activities.


name: NADD_ECOLI Nicotinate-nucleotide adenylyltransferase (sprot)

description: A nicotinate-nucleotide adenylyltransferase that is encoded in the genome of Escherichia coli K-12.


name: NADD_BACAC Probable nicotinate-nucleotide adenylyltransferase (sprot)

description: A nicotinate-nucleotide adenylyltransferase that is encoded in the genome of Bacillus anthracis str. CDC 684.


PI 3-Kg inhibitor

A quinoxaline derivative  that is quinoxaline in which the hydrogen at position 6 is replaced by a (2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl group. It is a potent inhibitor of the PI3Kgamma, with an IC50 of 8 nM and inhibits the progression of joint inflammation and damage in both lymphocyte-independent and dependent mouse models of rheumatoid arthritis.


name: RAF_MSV36 Serine/threonine-protein kinase-transforming protein raf (sprot)


name: HIF1A_HUMAN Hypoxia-inducible factor 1-alpha (sprot)

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


name: NAMPT_HUMAN Nicotinamide phosphoribosyltransferase (sprot)

description: A nicotinamide phosphoribosyltransferase that is encoded in the genome of human.


name: CATC_MOUSE Dipeptidyl peptidase 1 (sprot)

description: A dipeptidyl peptidase 1 that is encoded in the genome of mouse.


name: DSBB_ECOLI Disulfide bond formation protein B (sprot)

description: A disulfide bond formation protein B that is encoded in the genome of Escherichia coli K-12.


name: IMDH_CRYPV Inosine-5'-monophosphate dehydrogenase (sprot)


name: 4-Amino-benzoic acid 3-(1H-naphtho[2,3-d]imidazol-2-yl)-propyl ester


name: IMDH_BORBU Inosine-5'-monophosphate dehydrogenase (sprot)


name: IMDH_STRPY Inosine-5'-monophosphate dehydrogenase (sprot)


clonidine

A clonidine that is 4,5-dihydro-1H-imidazol-2-amine in which one of the amino hydrogens is replaced by a 2,6-dichlorophenyl group.


dopamine

Catechol in which the hydrogen at position 4 is substituted by a 2-aminoethyl group.


(±)-adrenaline

A catecholamine in which the aminoethyl side-chain is hydroxy-substituted at C-1 and methylated on nitrogen.


ergotamine

A peptide ergot alkaloid that is dihydroergotamine in which a double bond replaces the single bond between positions 9 and 10.


Lysergide

An ergoline alkaloid arising from formal condensation of lysergic acid with diethylamine.


noradrenaline

A catecholamine in which C-1 of the aminoethyl side-chain is hydroxy-substituted.


An organic cation obtained by protonation of the secondary amino function of phenylephrine.


BENZENE

A six-carbon aromatic annulene in which each carbon atom donates one of its two 2p electrons into a delocalised pi system. A toxic, flammable liquid byproduct of coal distillation, it is used as an industrial solvent. Benzene is a carcinogen that also damages bone marrow and the central nervous system.


name: ADA1A_RAT Alpha-1A adrenergic receptor (sprot)

description: An alpha-1A adrenergic receptor that is encoded in the genome of rat.


amitriptyline

An organic tricyclic compound that is 10,11-dihydro-5H-dibenzo[a,d][7]annulene substituted by a 3-(dimethylamino)propylidene group at position 5.


amphetamine

A primary amine that is isopropylamine in which a hydrogen attached to one of the methyl groups has been replaced by a phenyl group.


name: 3-hydroxy-2-phenylpropanoic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester


chlorpromazine

A substituted phenothiazine in which the ring nitrogen at position 10 is attached to C-3 of an N,N-dimethylpropanamine moiety.


dihydroergocryptine

alpha-Ergocryptine in which a single bond replaces the double bond between positions 9 and 10.


diphenhydramine

An ether that is the benzhydryl ether of 2-(dimethylamino)ethanol. It is a H1-receptor antagonist used as a antipruritic and antitussive drug.


(+)-adrenaline

The S-enantiomer of adrenaline.


hydralazine

The 1-hydrazino derivative of phthalazine; a direct-acting vasodilator that is used as an antihypertensive agent.


imipramine

A dibenzoazepine that is 5H-dibenzo[b,f]azepine substituted by a 3-(dimethylamino)propyl group at the nitrogen atom.


levisoprenaline

An optically active phenylethanolamine compound having an isopropyl substituent attached to the nitrogen atom.


methoxamine

An amphetamine in which the parent 1-phenylpropan-2-amine skeleton is substituted at position 1 with an hydroxy group and the phenyl ring is 2- and 5-substituted with methoxy groups. It is an antihypotensive agent (pressor), an agonist acting directly at alpha-adrenoceptors with selectivity for the alpha-1 adrenoceptor subtype similar to phenylephrine .


L-NOREPINEPHRINE

The S-enantiomer of noradrenaline.


octopaminium

The conjugate acid of octopamine; major species at pH 7.3.


phenylephrine

A member of the class of the class of phenylethanolamines that is (1R)-2-(methylamino)-1-phenylethan-1-ol carrying an additional hydroxy substituent at position 3 on the phenyl ring.


phenylethanolamine

The simplest member of the class of  phenylethanolamines that is 2-aminoethanol bearing a phenyl substituent at the 1-position. The parent of the phenylethanolamine class.


β-phenylethylamine

A phenylethylamine having the phenyl substituent at the 2-position.


promethazine

A  tertiary amine that is a substituted phenothiazine in which the ring nitrogen at position 10 is attached to C-3 of an N,N-dimethylpropan-2-amine moiety.


thioridazine

A phenothiazine derivative having a methylsulfanyl subsitituent at the 2-position and a (1-methylpiperidin-2-yl)ethyl] group at the N-10 position.


(+)-TRANYLCYPROMINE

A 2-phenylcyclopropan-1-amine that is the (1S,2R)-enantiomer of tranylcypromine.


tranylcypromine

A 2-phenylcyclopropan-1-amine that is the (1R,2S)-enantiomer of tranylcypromine.


trifluoperazine

A member of the class of phenothiazines that is  phenothiazine having a trifluoromethyl subsitituent at the 2-position and a 3-(4-methylpiperazin-1-yl)propyl group at the N-10 position.


tyramine

A primary amino compound obtained by formal decarboxylation of the amino acid tyrosine.


clonazepam

1,3-Dihydro-2H-1,4-benzodiazepin-2-one in which the hydrogens at positions 5 and 7 are substituted by 2-chlorophenyl and nitro groups, respectively. It is used in the treatment of all types of epilepsy and seizures, as well as myoclonus and associated abnormal movements, and panic disorders. However, its use can be limited by the development of tolerance and by sedation.


name: GBRA1_RAT Gamma-aminobutyric acid receptor subunit alpha-1 (sprot)

description: A gamma-aminobutyric acid receptor subunit alpha-1 that is encoded in the genome of rat.


prazosin

A member of the class of  piperazines that is piperazine substituted by a furan-2-ylcarbonyl group and a 4-amino-6,7-dimethoxyquinazolin-2-yl group at positions 1 and 4 respectively.


HRH1_RAT Histamine H1 receptor (sprot)

A histamine H1 receptor that is encoded in the genome of rat.


antazoline

A member of the class of imidazolines that is 2-aminomethyl-2-imidazoline in which the exocyclic amino hydrogens are replaced by benzyl and phenyl groups. Antazoline is only found in individuals that have taken the drug.


bromodiphenhydramine

A  tertiary amino compound that is the 4-bromobenzhydryl ether of 2-(dimethylamino)ethanol. An antihistamine with antimicrobial properties, it is used in the control of cutaneous allergies.


carbinoxamine

An organochlorine compound that is 2-(4-chlorobenzyl)pyridine in which one of the benzylic hydrogens is substituted by 2-(dimethylamino)ethoxy group. It is an ethanolamine-type antihistamine, used as its maleate salt for treating hay fever, as well as mild cases of Parkinson's disease.


cyproheptadine

The product resulting from the formal oxidative coupling of position 5 of 5H-dibenzo[a,d]cycloheptene with position 4 of 1-methylpiperidine resulting in the formation of a double bond between the two fragments. It is a sedating antihistamine with antimuscarinic and calcium-channel blocking actions. It is used (particularly as the hydrochloride sesquihydrate) for the relief of allergic conditions including rhinitis, conjunctivitis due to inhalant allergens and foods, urticaria and angioedema, and in pruritic skin disorders. Unlike other antihistamines, it is also a seratonin receptor antagonist, making it useful in conditions such as vascular headache and anorexia.


brompheniramine

Pheniramine in which the hydrogen at position 4 of the phenyl substituent is substituted by bromine. A histamine H1 receptor antagonist, brompheniramine is used (commonly as its maleate salt) for the symptomatic relief of allergic conditions, including rhinitis and conjunctivitis.


chlorpheniramine

A tertiary amino compound that is propylamine which is substituted at position 3 by a pyridin-2-yl group and a p-chlorophenyl group and in which the hydrogens attached to the nitrogen are replaced by methyl groups. A histamine H1 antagonist, it is used to relieve the symptoms of hay fever, rhinitis, urticaria, and asthma.