Brief Information of the Compound and Protein
Compound Name
 Compound Info 
3-[[2-[(propan-2-ylamino)methyl]phenyl]methyl]-2-sulfanylidene-7H-purin-6-one
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 PubChem ID
CID: 168277928
Canonical SMILES
CC(C)NCc1ccccc1Cn1c2nc[nH]c2c(=O)[nH]c1=S
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Compound Formula C16H19N5OS
Compound Structure
Protein Name
 Protein Info 
Myeloperoxidase
Protein Classification
Enzyme
>
Oxidoreductase
Uniprot ID
P05164
Gene Name
MPO
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000018 HL-60
 Cell Line Info 
Homo sapiens (Human)  1
1
IC50 = 80000 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 38.6 nM