Target
Aldo-keto reductase family 1 member B1 [K65Q]
Ligand
BDBM50038842
Substrate
n/a
Meas. Tech.
ChEMBL_31334 (CHEMBL645541)
IC50
18±n/a nM
Citation
 Malamas, MSHohman, TCMillen, J Novel spirosuccinimide aldose reductase inhibitors derived from isoquinoline-1,3-diones: 2-[(4-bromo-2-fluorophenyl)methyl]-6- fluorospiro[isoquinoline-4(1H),3'-pyrrolidine]-1,2',3,5'(2H)-tetrone and congeners. 1. J Med Chem 37:2043-58 (1994) [PubMed]  Article 
Target
Name:
Aldo-keto reductase family 1 member B1 [K65Q]
Synonyms:
AKR1B1 | ALDR_BOVIN | Aldose reductase
Type:
Protein
Mol. Mass.:
35916.27
Organism:
Bos taurus (Cattle)
Description:
P16116[K65Q]
Residue:
315
Sequence:
AHNIVLYTGAKMPILGLGTWKSPPGKVTEAVKVAIDLGYRHIDCAHVYQNENEVGLALQAKLQEQVVKREDLFIVSKLWCTYHDKDLVKGACQKTLSDLKLDYLDLYLIHWPTGFKPGKDFFPLDEDGNVIPSEKDFVDTWTAMEELVDEGLVKAIGVSNFNHLQVEKILNKPGLKYKPAVNQIECHPYLTQEKLIQYCNSKGIVVTAYSPLGSPDRPWAKPEDPSILEDPRIKAIADKYNKTTAQVLIRFPIQRNLIVIPKSVTPERIAENFQVFDFELDKEDMNTLLSYNRDWRACALVSCASHRDYPFHEEF
  
Inhibitor
Name:
BDBM50038842
Synonyms:
2-(1,3-benzothiazol-2-ylmethyl)-6-fluoro-1H,2'H,5'H-spiro[isoquinoline-4,3'-pyrrol | CHEMBL64543
Type:
Small organic molecule
Emp. Form.:
C20H12FN3O4S
Mol. Mass.:
409.39
SMILES:
Fc1ccc2C(=O)N(Cc3nc4ccccc4s3)C(=O)C3(CC(=O)NC3=O)c2c1
Structure:
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