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Target
Tyrosine-protein phosphatase non-receptor type 11
Ligand
BDBM503340
Substrate
n/a
Meas. Tech.
Biochemical Assay
IC50
3900±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:
BDBM503340
Synonyms:
6-amino-2-[3-(aminomethyl)-2-oxa- 8-azaspiro[4.5]decan-8-yl]-5-(2,3- dichlorophenyl)pyrimidine-4- carboxamide | US11033547, Compound 40 | US11696916, Compound 40
Type:
Small organic molecule
Emp. Form.:
C20H24Cl2N6O2
Mol. Mass.:
451.35
SMILES:
NCC1CC2(CO1)CCN(CC2)c1nc(N)c(-c2cccc(Cl)c2Cl)c(n1)C(N)=O |(5.5,-6.49,;6.41,-5.24,;5.78,-3.83,;4.28,-3.51,;4.12,-1.98,;5.52,-1.36,;6.55,-2.5,;4.12,-.44,;2.78,.33,;1.45,-.44,;1.45,-1.98,;2.78,-2.75,;.11,.33,;.11,1.87,;-1.22,2.64,;-1.22,4.18,;-2.55,1.87,;-3.89,2.64,;-5.22,1.87,;-6.55,2.64,;-6.55,4.18,;-5.22,4.95,;-5.22,6.49,;-3.89,4.18,;-2.55,4.95,;-2.55,.33,;-1.22,-.44,;-3.89,-.44,;-3.89,-1.98,;-5.22,.33,)|
Structure:
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