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Target
Aldo-keto reductase family 1 member B1
Ligand
BDBM50537706
Substrate
n/a
Meas. Tech.
ChEMBL_1970365 (CHEMBL4603183)
IC50
453000±n/a nM
Citation
 Tomohara, K; Hasegawa, N; Adachi, I; Horino, Y; Nose, T Early identification of promiscuous attributes of aldose reductase inhibitors using a DMSO-perturbation assay. Bioorg Med Chem Lett 30:0 (2020) [PubMed]  Article 
Target
Name:
Aldo-keto reductase family 1 member B1
Synonyms:
AKR1B1 | ALDR1 | ALDR_HUMAN | ALR2 | AR | Aldo-keto reductase family 1 member B1 (AKR1B1) | Aldose Reductase (ALR2) | Aldose reductase | Aldose reductase (AR)
Type:
Protein
Mol. Mass.:
35855.50
Organism:
Homo sapiens (Human)
Description:
P15121. 4LAU; 2IKI; 4LB4; 2FZD; 2FZ8; 1US0
Residue:
316
Sequence:
MASRLLLNNGAKMPILGLGTWKSPPGQVTEAVKVAIDVGYRHIDCAHVYQNENEVGVAIQEKLREQVVKREELFIVSKLWCTYHEKGLVKGACQKTLSDLKLDYLDLYLIHWPTGFKPGKEFFPLDESGNVVPSDTNILDTWAAMEELVDEGLVKAIGISNFNHLQVEMILNKPGLKYKPAVNQIECHPYLTQEKLIQYCQSKGIVVTAYSPLGSPDRPWAKPEDPSLLEDPRIKAIAAKHNKTTAQVLIRFPMQRNLVVIPKSVTPERIAENFKVFDFELSSQDMTTLLSYNRNWRVCALLSCTSHKDYPFHEEF
  
Inhibitor
Name:
BDBM50537706
Synonyms:
CHEMBL4635409
Type:
Small organic molecule
Emp. Form.:
C17H24N2O3
Mol. Mass.:
304.3841
SMILES:
[H][C@]12[#6]\[#6](=[#6](/[#6])-[#6])-[#6](=O)-[#6][C@@]1([#6])[#6@@H]2-[#6]-[#6]C1([#6])[#7]-[#6](=O)-[#7]-[#6]1=O |r|
Structure:
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