Brief Information of the Compound and Protein
Compound Name
 Compound Info 
4-mesyl-3-nitro-benzoic acid [2-keto-2-(2-thenylamino)ethyl] ester
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 PubChem ID
CID: 2409541
Canonical SMILES
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)OCC(=O)NCc1cccs1
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Compound Formula C15H14N2O7S2
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 ~ 29092.9 nM
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