Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(phenylmethyl) 2-(4-methylsulfonyl-2-nitro-phenyl)sulfinylethanoate
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 PubChem ID
CID: 1189521
Canonical SMILES
CS(=O)(=O)c1ccc(c(c1)[N+]([O-])=O)S(=O)CC(=O)OCc1ccccc1
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Compound Formula C16H15NO7S2
Compound Structure
Protein Name
 Protein Info 
Isocitrate dehydrogenase [NADP] cytoplasmic
Protein Classification
Enzyme
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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)  1
1
Potency ~ 5804.8 nM
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