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Target
Aldo-keto reductase family 1 member C3
Ligand
BDBM54706
Substrate
n/a
Meas. Tech.
S-Tetralol Oxidation Assay
IC50
650±110 nM
Citation
 Penning, TM; Adeniji, A; Marnett, LJ 2-beta-naphthyl-acetic acid analogs as AKR1C3 inhibitors and methods of using same US Patent  US11459295 Publication Date 10/4/2022
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:
BDBM54706
Synonyms:
2-(6-methoxy-2-naphthalenyl)acetic acid | 2-(6-methoxy-2-naphthyl)acetic acid | 2-(6-methoxynaphthalen-2-yl)acetic acid | 2-(6-methoxynaphthalen-2-yl)ethanoic acid | UNM-0000306103 | US11459295, Compound DesmethylNaproxen 10 | cid_32176
Type:
Small organic molecule
Emp. Form.:
C13H12O3
Mol. Mass.:
216.2326
SMILES:
COc1ccc2cc(CC(O)=O)ccc2c1
Structure:
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