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Target
Tyrosine-protein phosphatase non-receptor type 11
Ligand
BDBM503312
Substrate
n/a
Meas. Tech.
Biochemical Assay
IC50
590±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:
BDBM503312
Synonyms:
6-amino-2-[8-(aminomethyl)-6- azaspiro[3.4]octan-6-yl]-5-(2,3- dichlorophenyl)-pyrimidine-4- carboxamide | US11033547, Compound 11 | US11696916, Compound 11
Type:
Small organic molecule
Emp. Form.:
C19H22Cl2N6O
Mol. Mass.:
421.324
SMILES:
NCC1CN(CC11CCC1)c1nc(N)c(-c2cccc(Cl)c2Cl)c(n1)C(N)=O |(6.3,-.49,;5.67,-1.9,;4.14,-2.06,;3.11,-.92,;1.7,-1.54,;1.86,-3.08,;3.37,-3.4,;2.82,-4.83,;4.26,-5.39,;4.81,-3.95,;.37,-.77,;.37,.77,;-.96,1.54,;-.96,3.08,;-2.3,.77,;-3.63,1.54,;-4.96,.77,;-6.3,1.54,;-6.3,3.08,;-4.96,3.85,;-4.96,5.39,;-3.63,3.08,;-2.3,3.85,;-2.3,-.77,;-.96,-1.54,;-3.63,-1.54,;-3.63,-3.08,;-4.96,-.77,)|
Structure:
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