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TitleDiscovery of (Thienopyrimidin-2-yl)aminopyrimidines as Potent, Selective, and Orally Available Pan-PI3-Kinase and Dual Pan-PI3-Kinase/mTOR Inhibitors for the Treatment of Cancer.
Journal, issue, pagesJ. Med. Chem., Vol. 53, Page 1086-1097, Year 2010
Publish dateDec 10, 2009 (structure data deposition date)
AuthorsSutherlin, D.P. / Sampath, D. / Berry, M. / Castanedo, G. / Chang, Z. / Chuckowree, I. / Dotson, J. / Folkes, A. / Friedman, L. / Goldsmith, R. ...Sutherlin, D.P. / Sampath, D. / Berry, M. / Castanedo, G. / Chang, Z. / Chuckowree, I. / Dotson, J. / Folkes, A. / Friedman, L. / Goldsmith, R. / Heffron, T. / Lee, L. / Lesnick, J. / Lewis, C. / Mathieu, S. / Nonomiya, J. / Olivero, A. / Pang, J. / Prior, W.W. / Salphati, L. / Sideris, S. / Tian, Q. / Tsui, V. / Wan, N.C. / Wang, S. / Wiesmann, C. / Wong, S. / Zhu, B.Y.
External linksJ. Med. Chem. / PubMed:20050669
MethodsX-ray diffraction
Resolution2.9 - 3 Å
Structure data

PDB-3l13:
Crystal Structures of Pan-PI3-Kinase and Dual Pan-PI3-Kinase/mTOR Inhibitors
Method: X-RAY DIFFRACTION / Resolution: 3 Å

PDB-3l16:
Discovery of (thienopyrimidin-2-yl)aminopyrimidines as Potent, Selective, and Orally Available Pan-PI3-Kinase and Dual Pan-PI3-Kinase/mTOR Inhibitors for the Treatment of Cancer
Method: X-RAY DIFFRACTION / Resolution: 2.9 Å

PDB-3l17:
Discovery of (thienopyrimidin-2-yl)aminopyrimidines as Potent, Selective, and Orally Available Pan-PI3-Kinase and Dual Pan-PI3-Kinase/mTOR Inhibitors for the Treatment of Cancer
Method: X-RAY DIFFRACTION / Resolution: 3 Å

Chemicals

ChemComp-JZW:
[3-(6-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-4-morpholin-4-ylthieno[3,2-d]pyrimidin-2-yl)phenyl]methanol

ChemComp-JZX:
5-(6-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-4-morpholin-4-ylthieno[3,2-d]pyrimidin-2-yl)pyridin-2-amine

ChemComp-JZY:
4-methyl-5-(6-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-4-morpholin-4-ylthieno[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / kinase / ATP-binding / Nucleotide-binding / PI3K-gamma p110 gamma

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