Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetAldo-keto reductase family 1 member B1 [K65Q]
LigandBDBM16415
Substrate/Competitorn/a
Meas. Tech.ChEBML_31634
IC50 2700±n/a nM
Citation Sestanj, KBellini, FFung, SAbraham, NTreasurywala, AHumber, LSimard-Duquesne, NDvornik, D N-[5-(trifluoromethyl)-6-methoxy-1-naphthalenyl]thioxomethyl]- N-methylglycine (Tolrestat), a potent, orally active aldose reductase inhibitor. J Med Chem27:255-6 (1984) [PubMed]
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:
BDBM16415
n/a
NameBDBM16415
Synonyms:(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)acetic acid | 2-{2,4-dioxo-3-azatricyclo[7.3.1.0^{5,13}]trideca-1(12),5,7,9(13),10-pentaen-3-yl}acetic acid | Alrestatin | CHEMBL63055 | PiG | Spectrum_001449 | Tocris-0485
TypeSmall organic molecule
Emp. Form.C14H9NO4
Mol. Mass.255.2256
SMILESOC(=O)CN1C(=O)c2cccc3cccc(C1=O)c23
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: