Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetAldose reductase (AR)
LigandBDBM16623
Substrate/Competitorn/a
Meas. Tech.ChEMBL_457959
IC50 1100±n/a nM
Citation Ferrari, AMDegliesposti, GSgobba, MRastelli, G Validation of an automated procedure for the prediction of relative free energies of binding on a set of aldose reductase inhibitors. Bioorg Med Chem15:7865-77 (2007) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Aldose reductase (AR)
Name:Aldose reductase
Synonyms:AR | Aldo-keto reductase family 1 member B1 (AKR1B1) | Aldose Reductase (ALR2) | Aldose reductase
Type:Protein
Mol. Mass.:35855.50
Organism:Homo sapiens (Human)
Description:P15121. 4LAU; 2IKI; 4LB4; 2FZD; 2FZ8; 1US0
Residue:316
Sequence:
MASRLLLNNGAKMPILGLGTWKSPPGQVTEAVKVAIDVGYRHIDCAHVYQNENEVGVAIQ
EKLREQVVKREELFIVSKLWCTYHEKGLVKGACQKTLSDLKLDYLDLYLIHWPTGFKPGK
EFFPLDESGNVVPSDTNILDTWAAMEELVDEGLVKAIGISNFNHLQVEMILNKPGLKYKP
AVNQIECHPYLTQEKLIQYCQSKGIVVTAYSPLGSPDRPWAKPEDPSLLEDPRIKAIAAK
HNKTTAQVLIRFPMQRNLVVIPKSVTPERIAENFKVFDFELSSQDMTTLLSYNRNWRVCA
LLSCTSHKDYPFHEEF
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM16623
NameBDBM16623
Synonyms:6-[(5-chloro-1H-indole-2-)sulfonyl]-2,3-dihydropyridazin-3-one | CHEMBL240871 | Heterocyclic Sulfonylpyridazinone, 19b
TypeSmall organic molecule
Emp. Form.C12H8ClN3O3S
Mol. Mass.309.728
SMILESClc1ccc2[nH]c(cc2c1)S(=O)(=O)c1ccc(=O)[nH]n1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least:
n/a