Brief Information of the Compound and Protein
Compound Name
 Compound Info 
2-[3-[5-bromo-2-[4-[(3R)-3,4-dimethylpiperazin-1-yl]-3-methoxyanilino]pyrimidin-4-yl]phenyl]acetonitrile
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 PubChem ID
CID: 71713769
Canonical SMILES
COc1cc(Nc2ncc(Br)c(n2)-c2cccc(CC#N)c2)ccc1N1CCN(C)[C@H](C)C1
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Compound Formula C25H27BrN6O
Compound Structure
Protein Name
 Protein Info 
Serine/threonine-protein kinase PAK 1
Protein Classification
Enzyme
>
Kinase
>
Protein Kinase
>
STE protein kinase group
>
STE protein kinase STE20 family
>
STE protein kinase PAKA subfamily
Uniprot ID
Q13153
Gene Name
PAK1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000249 OVCAR-3
 Cell Line Info 
Homo sapiens (Human)  1
1
EC50 = 3590 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 72 nM