Brief Information of the Compound and Protein
Compound Name
 Compound Info 
AG-221
    Show/Hide
 PubChem ID
CID: 89683805
Canonical SMILES
CC(C)(O)CNc1nc(Nc2ccnc(c2)C(F)(F)F)nc(n1)-c1cccc(n1)C(F)(F)F
    Show/Hide
Compound Formula C19H17F6N7O
Compound Structure
Protein Name
 Protein Info 
Isocitrate dehydrogenase [NADP], mitochondrial
Protein Classification
Enzyme
>
Oxidoreductase
Uniprot ID
P48735
Gene Name
IDH2
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000013 Sf9
 Cell Line Info 
Spodoptera frugiperda (Fall armyworm)  1
1
IC50 = 9 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 35.9 nM
2 IC50 = 262 nM
3 IC50 = 269.1 nM
4 IC50 = 310 nM
5 IC50 = 340 nM
6 IC50 = 362 nM
7 IC50 = 1080 nM
8 IC50 > 20000 nM
9 IC50 > 100000 nM