Reaction Details
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Aldo-keto reductase family 1 member C3
Ligand
BDBM50337278
Substrate
n/a
Meas. Tech.
ChEMBL_726380 (CHEMBL1687512)
IC50
1500±n/a nM
Citation
Adeniji, AO; Twenter, BM; Byrns, MC; Jin, Y; Winkler, JD; Penning, TM Discovery of substituted 3-(phenylamino)benzoic acids as potent and selective inhibitors of type 5 17ß-hydroxysteroid dehydrogenase (AKR1C3). Bioorg Med Chem Lett 21:1464-8 (2011) [PubMed] Article More Info.:
Target
Name:
Aldo-keto reductase family 1 member C3
Synonyms:
17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3) | 3-alpha-HSD type 2 | AK1C3_HUMAN | AKR1C3 | Aldo-keto reductase family 1 member C3 | Aldo-keto reductase family 1 member C3 (AK1C3) | Aldo-keto reductase family 1 member C3 (AK1C3a) | Aldo-keto reductase family 1 member C3 (AKR1C3) | Aldo-keto-reductase family 1 member C3 | DDH1 | Dihydrodiol dehydrogenase 3 | Dihydrodiol dehydrogenase type I | Estradiol 17-beta-dehydrogenase | HSD17B5 | KIAA0119 | PGFS | Prostaglandin F synthase | Testosterone 17-beta-dehydrogenase 5 | Trans-1,2-dihydrobenzene-1,2-diol dehydrogenase
Type:
Enzyme
Mol. Mass.:
36859.86
Organism:
Homo sapiens (Human)
Description:
P42330
Residue:
323
Sequence:
MDSKHQCVKLNDGHFMPVLGFGTYAPPEVPRSKALEVTKLAIEAGFRHIDSAHLYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWSTFHRPELVRPALENSLKKAQLDYVDLYLIHSPMSLKPGEELSPTDENGKVIFDIVDLCTTWEAMEKCKDAGLAKSIGVSNFNRRQLEMILNKPGLKYKPVCNQVECHPYFNRSKLLDFCKSKDIVLVAYSALGSQRDKRWVDPNSPVLLEDPVLCALAKKHKRTPALIALRYQLQRGVVVLAKSYNEQRIRQNVQVFEFQLTAEDMKAIDGLDRNLHYFNSDSFASHPNYPYSDEY
Inhibitor
Name:
BDBM50337278
Synonyms:
2-(phenylamino)benzoic acid | 2-Phenylamino-benzoic acid | CHEMBL23832 | N-phenylanthranilic acid | US9271961, 2 | phenylanthranilic acid
Type:
Small organic molecule
Emp. Form.:
C13H11NO2
Mol. Mass.:
213.2319
SMILES:
OC(=O)c1ccccc1Nc1ccccc1
Structure:
