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TargetAldo-keto reductase family 1 member B1 [K65Q]
LigandBDBM16314
Substrate/Competitorn/a
Meas. Tech.ChEMBL_32263 (CHEMBL645597)
IC50 96±n/a nM
Citation Costantino, LRastelli, GVescovini, KCignarella, GVianello, PDel Corso, ACappiello, MMura, UBarlocco, D Synthesis, activity, and molecular modeling of a new series of tricyclic pyridazinones as selective aldose reductase inhibitors. J Med Chem39:4396-405 (1996) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Aldo-keto reductase family 1 member B1 [K65Q]
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:
AHNIVLYTGAKMPILGLGTWKSPPGKVTEAVKVAIDLGYRHIDCAHVYQNENEVGLALQA
KLQEQVVKREDLFIVSKLWCTYHDKDLVKGACQKTLSDLKLDYLDLYLIHWPTGFKPGKD
FFPLDEDGNVIPSEKDFVDTWTAMEELVDEGLVKAIGVSNFNHLQVEKILNKPGLKYKPA
VNQIECHPYLTQEKLIQYCNSKGIVVTAYSPLGSPDRPWAKPEDPSILEDPRIKAIADKY
NKTTAQVLIRFPIQRNLIVIPKSVTPERIAENFQVFDFELDKEDMNTLLSYNRDWRACAL
VSCASHRDYPFHEEF
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM16314
n/a
NameBDBM16314
Synonyms:2-{[6-methoxy-5-(trifluoromethyl)naphthalen-1-yl]-N-methylmethanethioamido}acetic acid | Alredase | CHEMBL436 | N-{[6-methoxy-5-(trifluoromethyl)naphthalen-1-yl]carbonothioyl}-N-methylglycine | Tolrestat
TypeSmall organic molecule
Emp. Form.C16H14F3NO3S
Mol. Mass.357.347
SMILESCOc1ccc2c(cccc2c1C(F)(F)F)C(=S)N(C)CC(O)=O
Structure
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