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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Tyrosine-protein phosphatase non-receptor type 11 | ||
| Ligand | BDBM503412 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | Biochemical Assay | ||
| IC50 | >10000±n/a nM | ||
| Citation |  Jorand-LeBrun, C; Boivin, R; Mochalkin, I; Johnson, T; Linde, N; Musch, D; Kumar, D Carboxamide-pyrimidine derivatives as SHP2 antagonists US Patent US11033547 Publication Date 6/15/2021 | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Tyrosine-protein phosphatase non-receptor type 11 | |||
| Name: | Tyrosine-protein phosphatase non-receptor type 11 | ||
| Synonyms: | 3.1.3.48 | PTN11_HUMAN | PTP-1D | PTP-2C | PTP2C | PTPN11 | Protein Tyrosine Phosphatase PPN11/Shp2 | Protein tyrosine phosphatase (PTP) Shp2 | Protein-Tyrosine Phosphatase SHP-2 | Protein-tyrosine phosphatase 1D | Protein-tyrosine phosphatase 2C | SH-PTP2 | SH-PTP3 | SHP-2 | SHP2 | SHPTP2 | Src homology phosphatase 2 (SHP-2) | Tyrosine-protein phosphatase non-receptor type 11 (PTPN11) | Tyrosine-protein phosphatase non-receptor type 11 (SHP-2) | Tyrosine-protein phosphatase non-receptor type 11 (SHP2) | ||
| Type: | Protein phosphatase | ||
| Mol. Mass.: | 68443.59 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | Q06124 | ||
| Residue: | 593 | ||
| Sequence: |
| ||
| BDBM503412 | |||
| n/a | |||
| Name | BDBM503412 | ||
| Synonyms: | (4M)-2-(4-amino-4-methylpiperidin-1- yl)-5-(2-chloro-4-fluoro-3- methoxyphenyl)-6-methylpyrimidine-4- carboxamide | US11033547, Compound 115 | US11033547, Compound 116 | US11696916, Compound 116 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C19H23ClFN5O2 | ||
| Mol. Mass. | 407.87 | ||
| SMILES | COc1c(F)ccc(c1Cl)-c1c(C)nc(nc1C(N)=O)N1CCC(C)(N)CC1 |(-2.67,5.36,;-4,4.59,;-4,3.05,;-5.33,2.28,;-6.67,3.05,;-5.33,.74,;-4,-.03,;-2.67,.74,;-2.67,2.28,;-1.33,3.05,;-1.33,-.03,;,.74,;,2.28,;1.33,-.03,;1.33,-1.57,;,-2.34,;-1.33,-1.57,;-2.67,-2.34,;-2.67,-3.88,;-4,-1.57,;2.67,-2.34,;2.67,-3.88,;4,-4.65,;5.33,-3.88,;5.73,-5.36,;6.67,-3.11,;5.33,-2.34,;4,-1.57,)| | ||
| Structure | 
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