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Target
Tyrosine-protein phosphatase non-receptor type 11
Ligand
BDBM503334
Substrate
n/a
Meas. Tech.
Biochemical Assay
IC50
1100±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:
BDBM503334
Synonyms:
6-amino-2-[8-(aminomethyl)-2-oxa- 6-azaspiro[3.4]octan-6-yl]-5-(2,3- dichloro-phenyl)pyrimidine-4- carboxamide | US11033547, Compound 34 | US11696916, Compound 34
Type:
Small organic molecule
Emp. Form.:
C18H20Cl2N6O2
Mol. Mass.:
423.296
SMILES:
NCC1CN(CC11COC1)c1nc(N)c(-c2cccc(Cl)c2Cl)c(n1)C(N)=O |(3.09,-5.72,;3.99,-4.47,;3.37,-3.06,;1.86,-2.74,;1.7,-1.21,;3.11,-.59,;4.14,-1.73,;5.33,-2.7,;6.3,-1.5,;5.11,-.53,;.37,-.44,;.37,1.1,;-.97,1.87,;-.97,3.41,;-2.3,1.1,;-3.64,1.87,;-4.97,1.1,;-6.3,1.87,;-6.3,3.41,;-4.97,4.18,;-4.97,5.72,;-3.64,3.41,;-2.3,4.18,;-2.3,-.44,;-.97,-1.21,;-3.64,-1.21,;-3.64,-2.75,;-4.97,-.44,)|
Structure:
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