Brief Information of the Compound and Protein
Compound Name
N-[(1S)-2-(dimethylamino)-1-phenylethyl]-6,6-dimethyl-3-[(2-methylthieno[3,2-d]pyrimidin-4-yl)amino]-1,4-dihydropyrrolo[3,4-c]pyrazole-5-carboxamide
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PubChem ID
CID: 25227462
SID: 136350046
Canonical SMILES
CN(C)C[C@@H](NC(=O)N1Cc2c(Nc3nc(C)nc4ccsc34)[nH]nc2C1(C)C)c1ccccc1
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Compound Formula C25H30N8OS
Compound Structure
Protein Name
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
CL000013 Sf9 Spodoptera frugiperda (Fall armyworm)  1
1
IC50 = 52 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 13.7 nM
2 IC50 = 14 nM
3 IC50 = 36 nM
4 IC50 = 39 nM
5 Ki = 15 nM
6 Ki = 39 nM