Brief Information of the Compound and Protein
Compound Name
6-[4-(aminomethyl)-4-methylpiperidin-1-yl]-3-(2,3-dichlorophenyl)sulfanylpyrazin-2-amine
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PubChem ID
CID: 118239405
Canonical SMILES
CC1(CN)CCN(CC1)c1cnc(Sc2cccc(Cl)c2Cl)c(N)n1
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Compound Formula C17H21Cl2N5S
Compound Structure
Protein Name
Tyrosine-protein phosphatase non-receptor type 11
Protein Classification
Enzyme
>
Phosphatase
>
Protein Phosphatase
>
Tyrosine protein phosphatase
Uniprot ID
Q06124
Gene Name
PTPN11
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000269 KYSE-520 Homo sapiens (Human)  1
1
IC50 = 88 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 23 nM
2 IC50 > 10000 nM
3 Ki = 22 nM
4 Km = 95380 nM
5 Km = 103200 nM
6 Km = 141600 nM