Brief Information of the Compound and Protein
Compound Name
2-[3-[5-chloro-2-[3-methoxy-4-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]phenyl]acetonitrile
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PubChem ID
CID: 71720361
Canonical SMILES
COc1cc(Nc2ncc(Cl)c(n2)-c2cccc(CC#N)c2)ccc1N1CCN(C)CC1
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Compound Formula C24H25ClN6O
Compound Structure
Protein Name
TRAF2 and NCK-interacting protein kinase
Protein Classification
Enzyme
>
Kinase
>
Protein Kinase
>
STE protein kinase group
>
STE protein kinase STE20 family
>
STE protein kinase MSN subfamily
Uniprot ID
Q9UKE5
Gene Name
TNIK
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000067 HCT 116 Homo sapiens (Human)  1
1
IC50 = 5.4 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 65 nM
2 Kd = 86 nM