Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetAldo-keto reductase family 1 member C4
LigandBDBM50241828
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1670547 (CHEMBL4020435)
IC50 350±n/a nM
Citation Endo, SXia, SSuyama, MMorikawa, YOguri, HHu, DAo, YTakahara, SHorino, YHayakawa, YWatanabe, YGouda, HHara, AKuwata, KToyooka, NMatsunaga, TIkari, A Synthesis of Potent and Selective Inhibitors of Aldo-Keto Reductase 1B10 and Their Efficacy against Proliferation, Metastasis, and Cisplatin Resistance of Lung Cancer Cells. J Med Chem60:8441-8455 (2017) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Aldo-keto reductase family 1 member C4
Name:Aldo-keto reductase family 1 member C4
Synonyms:3-alpha-HSD1 | 3-alpha-Hydroxysteroid Dehydrogenase Type 1 (AKR1C4) | 3-alpha-hydroxysteroid dehydrogenase type I | AK1C4_HUMAN | AKR1C4 | Aldo-keto reductase family 1 member C4 | Aldo-keto reductase family 1 member C4 (AK1C4) | CDR | CHDR | Chlordecone reductase | DD-4 | DD4 | Dihydrodiol dehydrogenase 4 | HAKRA
Type:Enzyme
Mol. Mass.:37068.40
Organism:Homo sapiens (Human)
Description:P17516
Residue:323
Sequence:
MDPKYQRVELNDGHFMPVLGFGTYAPPEVPRNRAVEVTKLAIEAGFRHIDSAYLYNNEEQ
VGLAIRSKIADGSVKREDIFYTSKLWCTFFQPQMVQPALESSLKKLQLDYVDLYLLHFPM
ALKPGETPLPKDENGKVIFDTVDLSATWEVMEKCKDAGLAKSIGVSNFNCRQLEMILNKP
GLKYKPVCNQVECHPYLNQSKLLDFCKSKDIVLVAHSALGTQRHKLWVDPNSPVLLEDPV
LCALAKKHKQTPALIALRYQLQRGVVVLAKSYNEQRIRENIQVFEFQLTSEDMKVLDGLN
RNYRYVVMDFLMDHPDYPFSDEY
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50241828
n/a
NameBDBM50241828
Synonyms:CHEMBL4089817
TypeSmall organic molecule
Emp. Form.C19H16FNO4
Mol. Mass.341.333
SMILESOc1ccc2cc(C(=O)NCCCc3ccc(F)cc3)c(=O)oc2c1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: