Reaction Details  Report a problem with these data
Target
Aldo-keto reductase family 1 member B1
Ligand
BDBM50513914
Substrate
n/a
Meas. Tech.
ChEMBL_1854905 (CHEMBL4355634)
IC50
20±n/a nM
Citation
 Sangshetti, J; Pathan, SK; Patil, R; Akber Ansari, S; Chhajed, S; Arote, R; Shinde, DB Synthesis and biological activity of structurally diverse phthalazine derivatives: A systematic review. Bioorg Med Chem 27:3979-3997 (2019) [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:
BDBM50513914
Synonyms:
CHEMBL4436968
Type:
Small organic molecule
Emp. Form.:
C17H12BrFN2O3
Mol. Mass.:
391.191
SMILES:
OC(=O)Cc1nn(Cc2cc(F)cc(Br)c2)c(=O)c2ccccc12
Structure:
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