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Target
Tyrosine-protein phosphatase non-receptor type 11
Ligand
BDBM503416
Substrate
n/a
Meas. Tech.
Biochemical Assay
IC50
530±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:
BDBM503416
Synonyms:
(5M)-2-[(1S)-1-amino-1,3- dihydrospiro[indene-2,4''-piperidin]-1''- yl]-5-(2,3-dichlorophenyl)-6- methylpyrimidine-4-carboxamide | US11033547, Compound 119 | US11033547, Compound 120 | US11033547, Compound 121 | US11033547, Compound 122 | US11033547, Compound 123 | US11033547, Compound 124 | US11033547, Compound 125 | US11033547, Compound 126 | US11033547, Compound 127 | US11033547, Compound 128 | US11033547, Compound 129 | US11033547, Compound 130 | US11033547, Compound 131 | US11696916, Compound 131
Type:
Small organic molecule
Emp. Form.:
C22H21Cl2N7O2
Mol. Mass.:
486.354
SMILES:
N[C@H]1c2cccnc2OC11CCN(CC1)c1nc(N)c(-c2cccc(Cl)c2Cl)c(n1)C(N)=O |r,wU:1.0,(4.07,3.3,;4.55,1.84,;6.01,1.36,;7.34,2.13,;8.68,1.36,;8.68,-.18,;7.34,-.95,;6.01,-.18,;4.55,-.66,;3.64,.59,;2.87,1.92,;1.33,1.92,;.56,.59,;1.33,-.74,;2.87,-.74,;-.98,.59,;-1.75,1.92,;-3.29,1.92,;-4.06,3.26,;-4.06,.59,;-5.6,.59,;-6.37,-.74,;-7.91,-.74,;-8.68,.59,;-7.91,1.92,;-8.68,3.26,;-6.37,1.92,;-6.77,3.41,;-3.29,-.74,;-1.75,-.74,;-4.06,-2.08,;-3.29,-3.41,;-5.6,-2.08,)|
Structure:
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