Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetIsocitrate dehydrogenase [NADP] cytoplasmic
LigandBDBM50029470
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1436945 (CHEMBL3388443)
Ki 2200±n/a nM
Citation Liu, ZYao, YKogiso, MZheng, BDeng, LQiu, JJDong, SLv, HGallo, JMLi, XNSong, Y Inhibition of cancer-associated mutant isocitrate dehydrogenases: synthesis, structure-activity relationship, and selective antitumor activity. J Med Chem57:8307-18 (2014) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Isocitrate dehydrogenase [NADP] cytoplasmic
Name:Isocitrate dehydrogenase [NADP] cytoplasmic
Synonyms:Cytosolic NADP-isocitrate dehydrogenase | IDH | IDH1 | IDHC_HUMAN | IDP | Isocitrate Dehydrogenase (IDH1) | Isocitrate dehydrogenase 1 (IDH1) | NADP(+)-specific ICDH | Oxalosuccinate decarboxylase | PICD
Type:Protein
Mol. Mass.:46661.29
Organism:Homo sapiens (Human)
Description:O75874
Residue:414
Sequence:
MSKKISGGSVVEMQGDEMTRIIWELIKEKLIFPYVELDLHSYDLGIENRDATNDQVTKDA
AEAIKKHNVGVKCATITPDEKRVEEFKLKQMWKSPNGTIRNILGGTVFREAIICKNIPRL
VSGWVKPIIIGRHAYGDQYRATDFVVPGPGKVEITYTPSDGTQKVTYLVHNFEEGGGVAM
GMYNQDKSIEDFAHSSFQMALSKGWPLYLSTKNTILKKYDGRFKDIFQEIYDKQYKSQFE
AQKIWYEHRLIDDMVAQAMKSEGGFIWACKNYDGDVQSDSVAQGYGSLGMMTSVLVCPDG
KTVEAEAAHGTVTRHYRMYQKGQETSTNPIASIFAWTRGLAHRAKLDNNKELAFFANALE
EVSIETIEAGFMTKDLAACIKGLPNVQRSDYLNTFEFMDKLGENLKIKLAQAKL
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50029470
n/a
NameBDBM50029470
Synonyms:CHEMBL3343447
TypeSmall organic molecule
Emp. Form.C13H12FNO2
Mol. Mass.233.2383
SMILESCc1cc(Cc2cccc(F)c2)n(O)c(=O)c1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: