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Target
Aldo-keto reductase family 1 member B1
Ligand
BDBM50049394
Substrate
n/a
Meas. Tech.
ChEMBL_490576 (CHEMBL981183)
IC50
1412.54±n/a nM
Citation
 Mercader, AG; Duchowicz, PR; Fernández, FM; Castro, EA; Bennardi, DO; Autino, JC; Romanelli, GP QSAR prediction of inhibition of aldose reductase for flavonoids. Bioorg Med Chem 16:7470-6 (2008) [PubMed]  Article 
Target
Name:
Aldo-keto reductase family 1 member B1
Synonyms:
ALDR_RAT | Akr1b1 | Akr1b4 | Aldose reductase | Aldr1
Type:
PROTEIN
Mol. Mass.:
35797.87
Organism:
Rattus norvegicus
Description:
ChEMBL_1512484
Residue:
316
Sequence:
MASHLELNNGTKMPTLGLGTWKSPPGQVTEAVKVAIDMGYRHIDCAQVYQNEKEVGVALQEKLKEQVVKRQDLFIVSKLWCTFHDQSMVKGACQKTLSDLQLDYLDLYLIHWPTGFKPGPDYFPLDASGNVIPSDTDFVDTWTAMEQLVDEGLVKAIGVSNFNPLQIERILNKPGLKYKPAVNQIECHPYLTQEKLIEYCHCKGIVVTAYSPLGSPDRPWAKPEDPSLLEDPRIKEIAAKYNKTTAQVLIRFPIQRNLVVIPKSVTPARIAENFKVFDFELSNEDMATLLSYNRNWRVCALMSCAKHKDYPFHAEV
  
Inhibitor
Name:
BDBM50049394
Synonyms:
5,4'-Dihydroxy-6,7-dimethoxyflavone | 5-Hydroxy-2-(4-hydroxy-phenyl)-6,7-dimethoxy-chromen-4-one | 5-hydroxy-2-(4-hydroxyphenyl)-6,7-dimethoxy-4H-chromen-4-one | CHEMBL348436 | Cirsimaritin | cid_188323 | cirsimartin
Type:
Small organic molecule
Emp. Form.:
C17H14O6
Mol. Mass.:
314.2895
SMILES:
COc1cc2oc(cc(=O)c2c(O)c1OC)-c1ccc(O)cc1
Structure:
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