Target Poor or Non Binder(s) Information
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T60857 | Target Info | |||
| Target Name | Dihydrodiol dehydrogenase type I (AKR1C3) | ||||
| Synonyms |
Trans-1,2-dihydrobenzene-1,2-diol dehydrogenase; Testosterone 17-beta-dehydrogenase 5; Prostaglandin F synthase; PGFS; KIAA0119; Indanol dehydrogenase; HSD17B5; HA1753; Dihydrodiol dehydrogenase 3; DDH1; DD3; DD-3; Chlordecone reductase homolog HAKRb; Aldo-keto reductase family 1 member C3; 3-alpha-hydroxysteroid dehydrogenase type 2; 3-alpha-HSD type II, brain; 3-alpha-HSD type 2; 17-beta-hydroxysteroid dehydrogenase type 5; 17-beta-HSD 5
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| Target Type | Successful Target | ||||
| Gene Name | AKR1C3 | ||||
| Biochemical Class | Short-chain dehydrogenases reductase | ||||
| UniProt ID | |||||
| Poor Binders of This Target (in total, 31 binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
PMID27607364-Compound-4
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Patented | Compound Info | ||
| Activity |
IC50 = 84000 nM
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[1] | |||
| Compound Name |
3,5-dichlorosalicylic acid
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Investigative | Compound Info | ||
| Synonyms |
3,5-DICHLOROSALICYLIC ACID; 3,5-Dichloro-2-hydroxybenzoic acid; 320-72-9; Benzoic acid, 3,5-dichloro-2-hydroxy-; Salicylic acid, 3,5-dichloro-; USAF DO-68; 2-Hydroxy-3,5-dichlorobenzoic acid; 3,5-Dichlorosalicylicacid; UNII-O6PXR32G3V; 3,5-Dichlorosalicyclic acid; HSDB 5562; EINECS 206-281-8; NSC 30109; 3,5-dichloro-2-hydroxy-benzoic acid; BRN 2210803; O6PXR32G3V; AI3-22601; CHEMBL449129; CNJGWCQEGROXEE-UHFFFAOYSA-N; C2U; ACMC-1CUK7; Salicylic acid,5-dichloro-; AC1Q3M9M; WLN: QVR BQ CG EG; DSSTox_RID_80582; DSSTox_CID_24914
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| Activity |
Ki = 94000 nM
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[2] | |||
| Compound Name |
Chembl4166474
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Investigative | Compound Info | ||
| Activity |
IC50 ~ 50000 nM
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[3] | |||
| Compound Name |
2-(9-Chloro-1h-Phenanthro[9,10-D]imidazol-2-Yl)benzene-1,3-Dicarbonitrile
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Investigative | Compound Info | ||
| Synonyms |
MF-63; UNII-7TU641M876; MF 63; CHEMBL412099; 7TU641M876; 2-(6-chloro-1H-phenanthro[9,10-d]imidazol-2-yl)isophthalonitrile; 2-(6-chloro-1H-phenanthro[9,10-d]imidazol-2-yl)-isophthalonitrile; 2-(6-chloro-3H-phenanthro[9,10-d]imidazol-2-yl)benzene-1,3-dicarbonitrile; MF63 compound; QCR-11; SCHEMBL1758220; DTXSID50581753; HMS3740M07; BCP21070; EX-A1887; MF63; MF 63; BDBM50227631; ZINC29136213; CS-0508; 1,3-Benzenedicarbonitrile, 2-(6-chloro-1H-phenanthro(9,10-d)imidazol-2-yl)-; 1,3-Benzenedicarbonitrile, 2-(9-chloro-1H-phenanthro(9,10-d)imidazol-2-yl)-; NCGC00485909-01; HY-13283; FT-0699579; J3.637.467E; A11488; W-5746; Q27268842; 2-(2,6-Dicyanophenyl)-6-chloro-1H-phenanthro[9,10-d]imidazole; 2-(9-Chloro-1H-phenanthro[9,10-d]imidazol-2-yl)-1,3-benzenedicarbonitrile
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| Activity |
IC50 ~ 50000 nM
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[4] | |||
| Compound Name |
Chembl4173733
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Investigative | Compound Info | ||
| Synonyms |
BDBM50277999
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| Activity |
IC50 ~ 50000 nM
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[3] | |||
| Compound Name |
Chembl4170286
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Investigative | Compound Info | ||
| Synonyms |
BDBM50278015
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| Activity |
IC50 ~ 50000 nM
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[3] | |||
| Compound Name |
Chembl4177097
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Investigative | Compound Info | ||
| Synonyms |
BDBM50277996
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| Activity |
IC50 ~ 50000 nM
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[3] | |||
| Compound Name |
(E)-2,3-Bis(4-methylsulfonylphenyl)prop-2-enoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2334915; BDBM50429338
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| Activity |
IC50 = 51000 nM
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[5] | |||
| Compound Name |
2-(3-Hydroxyphenyl)quinoline-4-carboxylic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2172252; Oprea1_306831; SCHEMBL4614391; CTK8A0069; ZINC35885; ALBB-011648; BBL013780; BDBM50396732; MFCD01459896; STK022237; AKOS000137600; MCULE-5394551811; ST005686; VS-04003; R4609; 2-(3-hydroxyphenyl)-4-quinolinecarboxylic acid; AB00096011-01; 4-quinolinecarboxylic acid, 2-(3-hydroxyphenyl)-; 2-(3-HYDROXY-PHENYL)-QUINOLINE-4-CARBOXYLIC ACID
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| Activity |
Ki = 54000 nM
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[6] | |||
| Compound Name |
(E)-2-(4-Methylsulfonylphenyl)-3-phenylprop-2-enoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1682539; BDBM50429350
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| Activity |
IC50 = 69800 nM
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[5] | |||
| Compound Name |
2-Benzoylbenzoic acid
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Investigative | Compound Info | ||
| Synonyms |
o-Benzoylbenzoic acid; Benzoic acid, 2-benzoyl-; Benzophenone-2-carboxylic acid; 2-Carboxybenzophenone; Benzoic acid, o-benzoyl-; o-Carboxybenzophenone; Benzophenone-2-carbonic acid; 2-Benzoquinonecarboxylic acid; BENZOYLBENZOIC ACID; 2-(phenylcarbonyl)benzoic acid; 2-BenzoYl-Benzoic Acid; NSC 6646; UNII-1N20Y812XW; o-benzoyl benzoic acid; MFCD00002472; CHEMBL196812; 1N20Y812XW; 2-Benzoylbenzoic acid, 98+%; Ortho-benzoylbenzoic acid; SKP 10A; HSDB 5249; Benzoic acid, benzoyl-; EINECS 201-612-2; BRN 1107841; AI3-15222; Benzoylbenzoesaure; benzoyl benzoic acid; o-benzoyl-benzoic acid; 0-benzoyl benzoic acid; 2-benzoyl benzoic acid; PubChem20125; ACMC-209q6h; (pR)-2-Benzoylbenzoic acid; (pS)-2-Benzoylbenzoic acid; Oprea1_391180; SCHEMBL76332; 4-10-00-02977 (Beilstein Handbook Reference); KSC206I7R; 2-Benzoylbenzoic acid, 98%; IFLab1_004537; RARECHEM AL BO 1426; DTXSID6058924; CTK1A6478; KS-00000CDE; TIMTEC-BB SBB016647; 1-carboxy-2-phenylcarbonylbenzene; NSC6646; ORTHO-BENZOYL BENZOIC ACID; HMS1424O05; ZINC157193; NSC-6646; STR03489; AKOS BBS-00000803; ANW-38199; BBL007937; BDBM50174202; LABOTEST-BB LT01143281; LABOTEST-BB LT03328148; LABOTEST-BB LT03333255; SBB016647; STK387490; AKOS000118995; AC-2859; AS00732; CCG-202854; MCULE-6199465138; IDI1_010292; OTAVA-BB 7020401721; B0103; BB 0220554; EU-0033235; FT-0611294; ST50211380; T8228; AG-205/01795007; SR-01000596918; Q-200252; SR-01000596918-1; Q27252633; F0902-7613
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| Activity |
IC50 = 70000 nM
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[7] | |||
| Compound Name |
3-(Phenacylamino)benzoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2172249; Cambridge id 7062200; Oprea1_528152; CTK3I0410; DTXSID90343670; ZINC237393; BDBM50396736; STK253759; AKOS001627660; Benzoic acid, 3-(benzoylmethylamino)-; MCULE-6199516287; 3-[(2-Oxo-2-phenylethyl)amino]benzoic acid; 3-[(2-Oxo-2-phenylethyl)amino]benzoic acid #; SR-01000250578; SR-01000250578-1
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| Activity |
Ki = 72000 nM
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[6] | |||
| Compound Name |
7-Benzoyl-4,5-dihydro-1,4-benzoxazepin-3(2H)-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1414132; 7-(phenylcarbonyl)-2H,4H,5H-benzo[f]1,4-oxazepin-3-one; 7-Benzoyl-4,5-dihydrobenzo[f][1,4]oxazepin-3(2H)-one; SMR000081175; ChemDiv2_002188; 7-benzoyl-4,5-dihydro-1,4-benzoxazepin-3-one; Oprea1_153482; MLS000051966; ZINC29010; HMS1375D10; HMS2495G19; ALBB-023732; BDBM50396729; MFCD03196966; SBB009858; STK733944; AKOS003293065; MCULE-5167563765; SDCCGMLS-0017995.P002; ST041896; R6630; SR-01000539895; SR-01000539895-1; 1,4-benzoxazepin-3(2H)-one, 7-benzoyl-4,5-dihydro-; 7-(phenylcarbonyl)-4,5-dihydro-1,4-benzoxazepin-3(2H)-one
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| Activity |
Ki = 76000 nM
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[6] | |||
| Compound Name |
(E)-2-(3-Chlorophenyl)-3-(4-methylsulfonylphenyl)prop-2-enoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2334936; BDBM50429329
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| Activity |
IC50 = 76700 nM
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[5] | |||
| Compound Name |
5-{[(4,5-Dimethyl-2-furyl)carbonyl]amino}-2-hydroxybenzoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2172240; CBMicro_047077; Oprea1_232249; Oprea1_240878; CTK7G0643; ZINC34926; BDBM50396741; AKOS000610334; MCULE-9637351790; ST050776; BIM-0047247.P001; SR-01000453013; SR-01000453013-1; 5-[(4,5-Dimethyl-2-furoyl)amino]-2-hydroxybenzoic acid #; 5-[(4,5-dimethyl(2-furyl))carbonylamino]-2-hydroxybenzoic acid; 5-{[(4,5-dimethylfuran-2-yl)carbonyl]amino}-2-hydroxybenzoic acid; 5-[(4,5-Dimethyl-furanyl-2-carbonyl)-amino]-2-hydroxy-benzoic acid
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| Activity |
Ki = 82000 nM
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[6] | |||
| Compound Name |
(E)-2-(4-Chlorophenyl)-3-(4-methylsulfonylphenyl)prop-2-enoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2334933; BDBM50429331
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| Activity |
IC50 = 86600 nM
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[5] | |||
| Compound Name |
N-[4-[Cyano(phenyl)methyl]phenyl]acetamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1580175; N-(4-(Cyano(Phenyl)Methyl)Phenyl)Acetamide; TimTec1_006913; Oprea1_224180; Oprea1_352822; MLS000711057; HMS1553K05; HMS2647C12; BDBM50396745; AKOS000540823; MCULE-6865932556; N-[4-(cyanophenylmethyl)phenyl]acetamide; SMR000280824; ST50002612; SR-01000390407; SR-01000390407-1
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| Activity |
Ki = 87000 nM
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[6] | |||
| Compound Name |
5-Methoxy-2-methyl-3-indoleacetic acid
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Investigative | Compound Info | ||
| Synonyms |
2-(5-methoxy-2-methyl-1H-indol-3-yl)acetic acid; 5 MIAA; 1H-Indole-3-acetic acid, 5-methoxy-2-methyl-; (5-Methoxy-2-methyl-1H-indol-3-yl)acetic acid; N-Deschlorobenzoyl indomethacin; 5-Methoxy-methylindoleacetic acid; 5-methoxy-2-methylindole-3-acetic acid; UNII-KY9AD0AQM0; KY9AD0AQM0; DESCHLOROBENZOYL INDOMETHACIN; 5-Methoxy-2-methyl-3-indoleacetic acid, 98%; (5-Methoxy-2-methyl-1H-indol-3-yl)-acetic acid; 2-(5-methoxy-2-methylindol-3-yl)acetic acid; 5-Methoxy-2-methylindol-3-ylacetic acid; EINECS 220-734-7; NSC 97026; 5-Methoxy-2-methyl indole acetic acid; PubChem16841; 5-MeO,2-Me-IAA; CHEMBL1058; Oprea1_768754; N-Deschlorobenzoylindomethacin; KSC204E7R; SCHEMBL454792; Indomethacin Related Compound A; CTK1A4278; KS-00000GMR; ZINC56398; DTXSID00183009; NSC97026; BBL008167; BDBM50427655; MFCD00005618; NSC-97026; SBB003362; STK118562; WT1398; AKOS001476087; CS-W008567; MCULE-1767701374; VI30296; 5-methoxy-2-methyl-indolyl acetic acid; NCGC00338891-01; 5-methoxy-2-methyl-3-indole acetic acid; AC-15884; AK-48991; SC-17835; ST056360; TS-03131; AB0059631; AM20040098; FT-0620554; 1H-Indole-3-aceticacid, 5-methoxy-2-methyl-; A-8985; A22462; AB01331434-02; 882M157; (5-Methoxy-2-methyl-1H-indol-3-yl)acetic acid #; 2882-15-7 5-METHOXY-2-METHYL-3-INDOLEACETIC ACID
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| Activity |
IC50 ~ 100000 nM
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[8] | |||
| Compound Name |
3-{[(4-Methylphenyl)sulfonyl]amino}benzoic acid
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Investigative | Compound Info | ||
| Synonyms |
3-(Toluene-4-sulfonylamino)-benzoic acid; 3-[(4-methylphenyl)sulfonylamino]benzoic acid; CHEMBL2172250; 3-(((4-methylphenyl)sulfonyl)amino)benzoic acid; 3-(4-Methylphenylsulfonamido)Benzoic Acid; 3-[[(4-methylphenyl)sulfonyl]amino]Benzoic acid; 3-([(4-Methylphenyl)sulfonyl]amino)benzoic acid; NSC143118; 3-(4-methylbenzenesulfonamido)benzoic acid; Oprea1_340321; Oprea1_483798; SCHEMBL11025715; CTK6B9205; ZINC58794; DTXSID70958201; ALBB-029632; 1803AE; BDBM50396735; MFCD00245717; SBB043311; STK045555; AKOS000264498; MCULE-5597243072; MS-7237; NSC-143118; KS-0000290Y; Benzoic acid, 3-(4-tolylsulfonylamino)-; 3-(4-Methylphenylsulfonylamino)benzoic acid; ST4005484; 3-((4-methylphenyl)sulfonamido)benzoic acid; EU-0029826; SR-01000579662; 3-([(4-Methylphenyl)sulfonyl]amino)benzoic acid #; 3-[(4-Methylbenzene-1-sulfonyl)amino]benzoic acid; SR-01000579662-1; Benzoic acid, 3-[[(4-methylphenyl)sulfonyl]amino]-; 3-(((4-Methylphenyl)sulfonyl)amino)benzoic acid, 95%; 3-{[(4-methylphenyl)sulfonyl]amino}benzenecarboxylic acid
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| Activity |
Ki = 111000 nM
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[6] | |||
| Compound Name |
2-[(3-Methyl-1H-pyrazol-1-yl)methyl]quinoline-4-carboxylic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2172251; 2-[(3-methylpyrazolyl)methyl]quinoline-4-carboxylic acid; 2-((3-Methyl-1H-pyrazol-1-yl)methyl)quinoline-4-carboxylic acid; CTK6C3046; ZINC2552538; BDBM50396733; MFCD05667197; SBB022644; STK349896; AKOS000311439; MCULE-6636819069; NCGC00301591-01; ST092766; AB01299873-01
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| Activity |
Ki = 117000 nM
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[6] | |||
| Compound Name |
5-{[(2,5-Dimethyl-3-furyl)carbonyl]amino}-2-hydroxybenzoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1373742; CBMicro_047652; MixCom6_002596; Oprea1_474695; Oprea1_816058; ZINC87131; BDBM50396742; AKOS000143753; MCULE-3361403320; BIM-0047474.P001; MLS-0291944.0001; SR-01000531221; SR-01000531221-1
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| Activity |
Ki = 118000 nM
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[6] | |||
| Compound Name |
N-[(6-Oxo-1H-pyrimidin-4-yl)methyl]pyrazolo[1,5-a]pyridine-2-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2172259; BDBM50396750
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| Activity |
Ki = 118000 nM
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[6] | |||
| Compound Name |
(E)-3-(3-Hydroxy-4-methoxyphenyl)-2-(3,4,5-trimethoxyphenyl)prop-2-enoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1642214; SCHEMBL5700860; BDBM50429352; 3-(3-Hydroxy-4-methoxy-phenyl)-2-(3,4,5-trimethoxy-phenyl)-acrylic acid; (2E)-3-(3-hydroxy-4-methoxyphenyl)-2-(3,4,5-trimethoxy phenyl)acrylic acid; (2E)-3-(3-hydroxy-4-methoxyphenyl)-2-(3,4,5-trimethoxyphenyl)prop-2-enoic acid
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| Activity |
IC50 = 121100 nM
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[5] | |||
| Compound Name |
(E)-3-(3,4-Dimethoxyphenyl)-2-naphthalen-1-ylprop-2-enoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2334927; BDBM50429335
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| Activity |
IC50 = 127800 nM
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[5] | |||
| Compound Name |
(E)-3-(4-Methylsulfonylphenyl)-2-phenylprop-2-enoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL405127; BDBM50374772
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| Activity |
IC50 = 139200 nM
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[5] | |||
| Compound Name |
3-(1H-Benzimidazol-2-ylamino)benzoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2172247; SCHEMBL3766427; CTK7I8693; ZINC795938; BDBM50396738; STK399851; AKOS000283143; MCULE-8187061107; 3-(benzimidazol-2-ylamino)benzoic acid; 3-(1H-Benzoimidazole-2-ylamino)benzoic acid; BB 0247839; ST45069163; 3-(1H-Benzoimidazol-2-ylamino)-benzoic acid; AQ-086/41476304
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| Activity |
Ki = 142000 nM
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[6] | |||
| Compound Name |
3-[(2,6-Dimethylpyrimidin-4-yl)amino]-4-methylbenzoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2172248; BDBM50396737; ZINC11907743; CCG-151202; MCULE-4021562087
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| Activity |
Ki = 144000 nM
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[6] | |||
| Compound Name |
4-[Methyl(phenylsulfonyl)amino]benzoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1896308; 4-(N-Methylphenylsulfonamido)Benzoic Acid; MLS000108053; 4-[benzenesulfonyl(methyl)amino]benzoic acid; CBMicro_000887; Cambridge id 5708176; Oprea1_581700; Oprea1_592489; SCHEMBL3718777; HMS2186G22; ZINC312952; ALBB-025124; SMSF0007051; BBL019319; BDBM50396734; MFCD01080648; SBB072424; STK362683; AKOS000387040; CB02171; MCULE-5849703335; SMR000104016; VS-06908; BIM-0000663.P001; R4106; ST45028179; benzoic acid, 4-[methyl(phenylsulfonyl)amino]-; 4-(N-METHYLBENZENESULFONAMIDO)BENZOIC ACID
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| Activity |
Ki = 148000 nM
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[6] | |||
| Compound Name |
3-[(2-Naphthylsulfonyl)amino]propanoic acid
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Investigative | Compound Info | ||
| Synonyms |
3-(naphthalene-2-sulfonylamino)propionic acid; 3-(naphthalene-2-sulfonamido)propanoic acid; 3-(naphthalen-2-ylsulfonylamino)propanoic acid; 3-(Naphthalene-2-sulfonylamino)-propionic acid; NSC626995; CHEMBL1328030; TimTec1_004847; Oprea1_214988; Oprea1_664417; 3-[(2-NAPHTHYLSULFONYL)AMINO]PROPANOICACID; MLS000123153; SCHEMBL6792532; CTK7J4427; HMS1547M07; HMS2450A23; ZINC155625; 7156AC; BDBM50396730; SBB027927; STK050167; AKOS000301311; MCULE-2349381016; NE39647; NSC-626995; N-(2-Naphthylsulfonyl)-.beta.-alanine; 3-(2-naphthylsulfonylamino)propanoic acid; N-(naphthalen-2-ylsulfonyl)-beta-alanine; NCI60_008557; SMR000123744; N-(2-NAPHTHYLSULFONYL)-BETA-ALANINE; ST4053873; EN300-09570; SR-01000370514; SR-01000370514-1
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| Activity |
Ki = 148000 nM
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[6] | |||
| Compound Name |
Jasmonic acid
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Investigative | Compound Info | ||
| Synonyms |
(-)-Jasmonic acid; Jasmonate; trans-Jasmonic Acid; UNII-6RI5N05OWW; (+/-)-Jasmonic acid; 3-Oxo-2-(2-pentenyl)cyclopentaneacetic acid; (3R,7R)-Jasmonic acid; {(1R,2R)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetic acid; 6RI5N05OWW; (1R,2R)-3-oxo-2-(pent-2Z-enyl)-cyclopentaneacetic acid; CHEMBL449572; 2-[(1R,2R)-3-oxo-2-[(Z)-pent-2-enyl]cyclopentyl]acetic acid; Cyclopentaneacetic acid, 3-oxo-2-(2Z)-2-pentenyl-, (1R,2R)-; TNP00291; (-)-jasmonate; {(1R,2R)-3-Oxo-2-[(Z)pent-2-enyl]cyclopent-2-enyl}acetic acid; 2-{(1R,2R)-3-oxo-2-[(Z)-pent-2-enyl]cyclopentyl}acetate; 2-[(1R,2R)-2-((2Z)pent-2-enyl)-3-oxocyclopentyl]acetic acid; (+-)-Jasmonic acid; ()-Jasmonic acid; bmse000525; SCHEMBL114054; DTXSID4037665; (3R,7R)-(?)-Jasmonic acid; CMC_7387; ZINC4492883; 1054AH; BDBM50396691; CMC_13965; LMFA02020001; NCGC00017349-01; NCGC00017349-02; NCGC00142527-01; ST057248; HY-122464; CS-0085641; A14333; C08491; Q415311; J-502581; 3-Oxo-2R-(2Z)2-penten-1R-ylcyclopentaneacetic acid; E9BF63E8-55FE-4051-AE00-04B002D8CE1F; (1R,2R)-3-oxo-2-(2Z)-2-penten-ylcyclopentanacetic acid; (1r,2r)-3-oxo-2-(2z)-2-pentenyl-cyclopentaneacetic acid; (Z)-2-(2-(but-2-en-1-yl)-4-oxocyclopentyl)-acetic acid; ()-1alpha,2beta-3-Oxo-2-(cis-2-pentenyl)cyclopentaneacetic acid; (-)-1alpha,2beta-3-Oxo-2-(cis-2-pentenyl)cyclopentaneacetic acid; 2-((1R,2R)-2-((Z)-But-2-en-1-yl)-4-oxocyclopentyl)acetic acid; Cyclopentaneacetic acid, 3-oxo-2-(2-pentenyl)-, (Z)-trans- (8CI); cyclopentaneacetic acid, 3-oxo-2-[(2Z)-2-pentenyl]-, (1R,2R)-; Cyclopentaneacetic acid, 3-oxo-2-(2-pentenyl)-, [1R-[1alpha,2beta(Z)]]-; Cyclopentaneacetic acid, 3-oxo-2-(2Z)-2-pentenyl-, (1R,2R)- (9CI)
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| Activity |
Ki = 162000 nM
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[9] | |||
| Compound Name |
4-Methoxybenzophenone
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Investigative | Compound Info | ||
| Synonyms |
(4-Methoxyphenyl)(phenyl)methanone; p-Methoxybenzophenone; Methanone, (4-methoxyphenyl)phenyl-; Benzophenone, 4-methoxy-; 4-Benzoylanisole; (4-Methoxyphenyl)phenylmethanone; MFCD00008403; (4-methoxyphenyl)-phenylmethanone; UNII-I4XJ07373M; para-methoxybenzophenone; 4-Methoxybenzophenone, 97%; 4-methoxyphenyl phenyl ketone; CHEMBL198085; I4XJ07373M; Phenyl p-anisyl ketone; NSC 2194; EINECS 210-285-5; Benzophenone, 4-methoxy- (6CI,8CI); AI3-00785; (4-methoxyphenyl)-phenyl-methanone; p-methoxy benzophenone; PubChem21427; ACMC-209mpw; ChemDiv3_000362; SCHEMBL50261; cid_69146; KSC354E1R; MLS000720066; CTK2F4218; DTXSID00209995; NSC2194; HMS1474A10; HMS2592M22; ZINC244531; KS-00000C3A; NSC-2194; ANW-33714; BBL023540; BDBM50174205; SBB056759; STL286831; (4-Methoxyphenyl)(phenyl)methanone #; AKOS000120669; MCULE-7136054135; PS-7987; NCGC00175648-01; AC-12233; AK-87659; SC-65106; SMR000304595; SY015494; AB0010884; DB-053808; BB 0220632; FT-0602810; M0357; ST50307964; M-2064; AB00614512-07; A833084; AF-753/00317053; SR-01000397672; SR-01000397672-1; W-105184; BRD-K76902650-001-01-2; Q27280450; Z53836180; 4-Fluoro-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylicacid
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| Activity |
IC50 = 180000 nM
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[7] | |||
| Click to Show/Hide the Information of All Poor Binders | |||||
| References | Top | ||||
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| REF 1 | US patent application no. 9271961B2, Bifunctional AKR1C3 inhibitors/androgen receptor modulators and methods of use thereof | ||||
| REF 2 | Selectivity determinants of inhibitor binding to human 20alpha-hydroxysteroid dehydrogenase: crystal structure of the enzyme in ternary complex with coenzyme and the potent inhibitor 3,5-dichlorosalicylic acid. J Med Chem. 2008 Aug 14;51(15):4844-8. | ||||
| REF 3 | Hydroxytriazole derivatives as potent and selective aldo-keto reductase 1C3 (AKR1C3) inhibitors discovered by bioisosteric scaffold hopping approach. Eur J Med Chem. 2017 Oct 20;139:936-946. | ||||
| REF 4 | Trisubstituted ureas as potent and selective mPGES-1 inhibitors. Bioorg Med Chem Lett. 2011 Mar 1;21(5):1488-92. | ||||
| REF 5 | 2,3-Diarylpropenoic acids as selective non-steroidal inhibitors of type-5 17-hydroxysteroid dehydrogenase (AKR1C3). Eur J Med Chem. 2013 Apr;62:89-97. | ||||
| REF 6 | Selective inhibitors of aldo-keto reductases AKR1C1 and AKR1C3 discovered by virtual screening of a fragment library. J Med Chem. 2012 Sep 13;55(17):7417-24. | ||||
| REF 7 | Nonsteroidal anti-inflammatory drugs and their analogues as inhibitors of aldo-keto reductase AKR1C3: new lead compounds for the development of ant... Bioorg Med Chem Lett. 2005 Dec 1;15(23):5170-5. | ||||
| REF 8 | Development of potent and selective indomethacin analogues for the inhibition of AKR1C3 (Type 5 17-hydroxysteroid dehydrogenase/prostaglandin F synthase) in castrate-resistant prostate cancer. J Med Chem. 2013 Mar 28;56(6):2429-46. | ||||
| REF 9 | 3-(3,4-Dihydroisoquinolin-2(1H)-ylsulfonyl)benzoic Acids: highly potent and selective inhibitors of the type 5 17--hydroxysteroid dehydrogenase AKR1C3. J Med Chem. 2012 Sep 13;55(17):7746-58. | ||||
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