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Target
Aldo-keto reductase family 1 member B1
Ligand
BDBM50526551
Substrate
n/a
Meas. Tech.
ChEMBL_1900178 (CHEMBL4402293)
IC50
23890±n/a nM
Citation
 Ji, Y; Chen, X; Chen, H; Zhang, X; Fan, Z; Xie, L; Ma, B; Zhu, C Designing of acyl sulphonamide based quinoxalinones as multifunctional aldose reductase inhibitors. Bioorg Med Chem 27:1658-1669 (2019) [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:
BDBM50526551
Synonyms:
CHEMBL4547451
Type:
Small organic molecule
Emp. Form.:
C20H16F3N3O6S
Mol. Mass.:
483.418
SMILES:
COc1cc(\C=C\c2nc3ccccc3n(CC(=O)NS(=O)(=O)C(F)(F)F)c2=O)ccc1O
Structure:
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