Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetKetohexokinase
LigandBDBM50241178
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1843863 (CHEMBL4344290)
IC50 340±n/a nM
Citation Romero, FAJones, CTXu, YFenaux, MHalcomb, RL The Race to Bash NASH: Emerging Targets and Drug Development in a Complex Liver Disease. J Med Chem63:5031-5073 (2020) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Ketohexokinase
Name:Ketohexokinase
Synonyms:2.7.1.3 | Hepatic fructokinase | KHK_RAT | Ketohexokinase | Khk
Type:PROTEIN
Mol. Mass.:32749.44
Organism:Rattus norvegicus
Description:ChEMBL_117528
Residue:298
Sequence:
MEEKQILCVGLVVLDIINVVDKYPEEDTDRRCLSQRWQRGGNASNSCTVLSLLGARCAFM
GSLAHGHVADFLVADFRRRGVDVSQVAWQSQGDTPCSCCIVNNSNGSRTIILYDTNLPDV
SAKDFEKVDLTRFKWIHIEGRNASEQVKMLQRIEQYNATQPLQQKVRVSVEIEKPREELF
QLFGYGEVVFVSKDVAKHLGFRSAGEALKGLYSRVKKGATLICAWAEEGADALGPDGQLL
HSDAFPPPRVVDTLGAGDTFNASVIFSLSKGNSMQEALRFGCQVAGKKCGLQGFDGIV
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50241178
n/a
NameBDBM50241178
Synonyms:CHEMBL4070442
TypeSmall organic molecule
Emp. Form.C16H19F3N4O3
Mol. Mass.372.3423
SMILESC[C@]1(O)CCN(C1)c1nc(cc(c1C#N)C(F)(F)F)N1C[C@H](O)[C@@H](O)C1 |r|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: