Brief Information of the Compound and Protein
Compound Name
SHP099
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PubChem ID
CID: 118238298
Canonical SMILES
CC1(N)CCN(c2cnc(-c3cccc(Cl)c3Cl)c(N)n2)CC1
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Compound Formula C16H19Cl2N5
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 = 250 nM
   TI
   LI
   LO
   TS
CL000091 MV4-11 Homo sapiens (Human)  1
1
IC50 = 0.145 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 39.7 nM
2 IC50 = 70 nM
3 IC50 = 71 nM
4 IC50 = 136.2 nM
5 IC50 > 10000 nM
6 Ki = 67 nM
7 Km = 89330 nM
8 Km = 90170 nM
9 Km = 135700 nM