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Target
Tyrosine-protein phosphatase non-receptor type 11
Ligand
BDBM503330
Substrate
n/a
Meas. Tech.
Biochemical Assay
IC50
110±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 
Target
Name:
Tyrosine-protein phosphatase non-receptor type 11
Synonyms:
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 2C | SH-PTP3 | SHP2 | SHPTP2 | Src homology phosphatase 2 (SHP-2) | Tyrosine-protein phosphatase non-receptor type 11 | 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:
597
Sequence:
MTSRRWFHPNITGVEAENLLLTRGVDGSFLARPSKSNPGDFTLSVRRNGAVTHIKIQNTGDYYDLYGGEKFATLAELVQYYMEHHGQLKEKNGDVIELKYPLNCADPTSERWFHGHLSGKEAEKLLTEKGKHGSFLVRESQSHPGDFVLSVRTGDDKGESNDGKSKVTHVMIRCQELKYDVGGGERFDSLTDLVEHYKKNPMVETLGTVLQLKQPLNTTRINAAEIESRVRELSKLAETTDKVKQGFWEEFETLQQQECKLLYSRKEGQRQENKNKNRYKNILPFDHTRVVLHDGDPNEPVSDYINANIIMPEFETKCNNSKPKKSYIATQGCLQNTVNDFWRMVFQENSRVIVMTTKEVERGKSKCVKYWPDEYALKEYGVMRVRNVKESAAHDYTLRELKLSKVGQALLQGNTERTVWQYHFRTWPDHGVPSDPGGVLDFLEEVHHKQESIMDAGPVVVHCSAGIGRTGTFIVIDILIDIIREKGVDCDIDVPKTIQMVRSQRSGMVQTEAQYRFIYMAVQHYIETLQRRIEEEQKSKRKGHEYTNIKYSLADQTSGDQSPLPPCTPTPPCAEMREDSARVYENVGLMQQQKSFR
  
Inhibitor
Name:
BDBM503330
Synonyms:
(4M)-2-(4-amino-4-methyl- piperidin-1-yl)-5-(2,3-dichloro- phenyl)-6-methylpyrimidine-4- carboxamide | US11033547, Compound 30 | US11033547, Compound 31 | US11696916, Compound 31
Type:
Small organic molecule
Emp. Form.:
C18H21Cl2N5O
Mol. Mass.:
394.298
SMILES:
Cc1nc(nc(C(N)=O)c1-c1cccc(Cl)c1Cl)N1CCC(C)(N)CC1 |(-1.46,2.72,;-1.07,1.23,;.42,.84,;.82,-.65,;-.27,-1.74,;-1.76,-1.34,;-2.84,-2.43,;-2.45,-3.92,;-4.33,-2.03,;-2.15,.15,;-3.64,.54,;-4.73,-.54,;-6.22,-.15,;-6.62,1.34,;-5.53,2.43,;-5.93,3.92,;-4.04,2.03,;-3.64,3.52,;2.31,-1.05,;2.71,-2.54,;4.19,-2.94,;5.28,-1.85,;6.05,-3.18,;6.62,-1.08,;4.88,-.36,;3.4,.04,)|
Structure:
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