Brief Information of the Compound and Protein
Compound Name
 Compound Info 
US10640534, Compound 176
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 PubChem ID
CID: 71657455
Canonical SMILES
Fc1cncc(c1)N([C@H](C(=O)NC1CC(F)(F)C1)c1ccccc1Cl)C(=O)[C@@H]1CCC(=O)N1c1cc(ccn1)C#N
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Compound Formula C28H22ClF3N6O3
Compound Structure
Protein Name
 Protein Info 
Isocitrate dehydrogenase [NADP] cytoplasmic
Protein Classification
Enzyme
>
Oxidoreductase
Uniprot ID
O75874
Gene Name
IDH1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000156 HT-1080
 Cell Line Info 
Homo sapiens (Human)  2
1
IC50 = 7.5 nM
   TI
   LI
   LO
   TS
2
IC50 = 25.4 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 19 nM
2 IC50 = 63 nM
3 IC50 = 65 nM