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TitleStructure-based optimization of pyrazolo-pyrimidine and -pyridine inhibitors of PI3-kinase.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 20, Page 6048-6051, Year 2010
Publish dateJul 16, 2010 (structure data deposition date)
AuthorsStaben, S.T. / Heffron, T.P. / Sutherlin, D.P. / Bhat, S.R. / Castanedo, G.M. / Chuckowree, I.S. / Dotson, J. / Folkes, A.J. / Friedman, L.S. / Lee, L. ...Staben, S.T. / Heffron, T.P. / Sutherlin, D.P. / Bhat, S.R. / Castanedo, G.M. / Chuckowree, I.S. / Dotson, J. / Folkes, A.J. / Friedman, L.S. / Lee, L. / Lesnick, J. / Lewis, C. / Murray, J.M. / Nonomiya, J. / Olivero, A.G. / Plise, E. / Pang, J. / Prior, W.W. / Salphati, L. / Rouge, L. / Sampath, D. / Tsui, V. / Wan, N.C. / Wang, S. / Wiesmann, C. / Wu, P. / Zhu, B.Y.
External linksBioorg. Med. Chem. Lett. / PubMed:20822905
MethodsX-ray diffraction
Resolution2.6 - 2.75 Å
Structure data

PDB-3nzs:
Structure-based Optimization of Pyrazolo -Pyrimidine and -Pyridine Inhibitors of PI3-Kinase
Method: X-RAY DIFFRACTION / Resolution: 2.75 Å

PDB-3nzu:
Structure-based Optimization of Pyrazolo -Pyrimidine and -Pyridine Inhibitors of PI3-Kinase
Method: X-RAY DIFFRACTION / Resolution: 2.6 Å

Chemicals

ChemComp-NZS:
6-(1,1-dioxidothiomorpholin-4-yl)-N-(3-methoxyphenyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine

ChemComp-NZU:
6-(2H-indazol-4-yl)-1-methyl-N-[3-(methylsulfonyl)propyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Source
  • homo sapiens (human)
KeywordsTRANSFERASE/TRANSFERASE INHIBITOR / kinase p110 / TRANSFERASE-TRANSFERASE INHIBITOR complex

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