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Target
Aldo-keto reductase family 1 member C4
Ligand
BDBM17638
Substrate
n/a
Meas. Tech.
ChEMBL_821632 (CHEMBL2038587)
IC50
54000±n/a nM
Citation
 Endo, S; Matsunaga, T; Kanamori, A; Otsuji, Y; Nagai, H; Sundaram, K; El-Kabbani, O; Toyooka, N; Ohta, S; Hara, A Selective inhibition of human type-5 17ß-hydroxysteroid dehydrogenase (AKR1C3) by baccharin, a component of Brazilian propolis. J Nat Prod 75:716-21 (2012) [PubMed]  Article 
Target
Name:
Aldo-keto reductase family 1 member C4
Synonyms:
CDR | Chlordecone reductase | HAKRA | Aldo-keto reductase family 1 member C4 | DD4 | 3-alpha-HSD1 | Dihydrodiol dehydrogenase 4 | DD-4 | 3-alpha-hydroxysteroid dehydrogenase type I | 3-alpha-Hydroxysteroid Dehydrogenase Type 1 (AKR1C4) | AK1C4_HUMAN | AKR1C4 | CHDR | Aldo-keto reductase family 1 member C4 (AK1C4)
Type:
Enzyme
Mol. Mass.:
37068.40
Organism:
Human
Description:
P17516
Residue:
323
Sequence:
MDPKYQRVELNDGHFMPVLGFGTYAPPEVPRNRAVEVTKLAIEAGFRHIDSAYLYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWCTFFQPQMVQPALESSLKKLQLDYVDLYLLHFPMALKPGETPLPKDENGKVIFDTVDLSATWEVMEKCKDAGLAKSIGVSNFNCRQLEMILNKPGLKYKPVCNQVECHPYLNQSKLLDFCKSKDIVLVAHSALGTQRHKLWVDPNSPVLLEDPVLCALAKKHKQTPALIALRYQLQRGVVVLAKSYNEQRIRENIQVFEFQLTSEDMKVLDGLNRNYRYVVMDFLMDHPDYPFSDEY
  
Inhibitor
Name:
BDBM17638
Synonyms:
indometacin | Indocin | 2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl-1H-indol-3-yl}acetic acid | CHEMBL6 | Indomethacin | US9271961, Indomethacin | US11478464, Compound Indomethacin | US11786535, Compound Indomethacin
Type:
Small organic molecule
Emp. Form.:
C19H16ClNO4
Mol. Mass.:
357.08
SMILES:
Cc1c(c2cc(ccc2n1C(=O)c3ccc(cc3)Cl)OC)CC(=O)O
Structure:
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