Brief Information of the Compound and Protein
Compound Name
[2-(dimethylamino)-2-oxoethyl] 4-[4-[[5-chloro-4-(2-propan-2-ylsulfonylanilino)pyrimidin-2-yl]amino]-2-methyl-5-propan-2-yloxyphenyl]piperidine-1-carbodithioate
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PubChem ID
CID: 168286843
Canonical SMILES
CC(C)Oc1cc(C2CCN(CC2)C(=S)SCC(=O)N(C)C)c(C)cc1Nc1ncc(Cl)c(Nc2ccccc2S(=O)(=O)C(C)C)n1
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Compound Formula C33H43ClN6O4S3
Compound Structure
Protein Name
ALK tyrosine kinase receptor
Protein Classification
Enzyme
>
Kinase
>
Protein Kinase
>
TKL protein kinase group
>
TKL protein kinase STKR family
>
TKL protein kinase STKR Type 1 subfamily
Uniprot ID
Q9UM73
Gene Name
ALK
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000012 Sf21 Spodoptera frugiperda (Fall armyworm)  2
1
IC50 = 16 nM
   TI
   LI
   LO
   TS
2
IC50 > 200 nM
   TI
   LI
   LO
   TS