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Target
Aldo-keto reductase family 1 member B1
Ligand
BDBM50168013
Substrate
n/a
Meas. Tech.
ChEMBL_1574573 (CHEMBL3800856)
IC50
7200±n/a nM
Citation
 Zhu, S; Hao, X; Zhang, S; Qin, X; Chen, X; Zhu, C Synthesis of benzothiadiazine derivatives exhibiting dual activity as aldose reductase inhibitors and antioxidant agents. Bioorg Med Chem Lett 26:2880-2885 (2016) [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:
BDBM50168013
Synonyms:
CHEMBL3797906
Type:
Small organic molecule
Emp. Form.:
C17H17BrN2O5S
Mol. Mass.:
441.296
SMILES:
COc1ccc(CN2CN(CC(O)=O)c3ccc(Br)cc3S2(=O)=O)cc1
Structure:
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