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TitleDesign and Synthesis of Novel Human Epidermal Growth Factor Receptor 2 (HER2)/Epidermal Growth Factor Receptor (EGFR) Dual Inhibitors Bearing a Pyrrolo[3,2-d]pyrimidine Scaffold.
Journal, issue, pagesJ. Med. Chem., Vol. 54, Page 8030-8050, Year 2011
Publish dateMar 30, 2011 (structure data deposition date)
AuthorsIshikawa, T. / Seto, M. / Banno, H. / Kawakita, Y. / Oorui, M. / Taniguchi, T. / Ohta, Y. / Tamura, T. / Nakayama, A. / Miki, H. ...Ishikawa, T. / Seto, M. / Banno, H. / Kawakita, Y. / Oorui, M. / Taniguchi, T. / Ohta, Y. / Tamura, T. / Nakayama, A. / Miki, H. / Kamiguchi, H. / Tanaka, T. / Habuka, N. / Sogabe, S. / Yano, J. / Aertgeerts, K. / Kamiyama, K.
External linksJ. Med. Chem. / PubMed:22003817
MethodsX-ray diffraction
Resolution3.21 Å
Structure data

PDB-3rcd:
HER2 Kinase Domain Complexed with TAK-285
Method: X-RAY DIFFRACTION / Resolution: 3.21 Å

Chemicals

ChemComp-03P:
N-{2-[4-({3-chloro-4-[3-(trifluoromethyl)phenoxy]phenyl}amino)-5H-pyrrolo[3,2-d]pyrimidin-5-yl]ethyl}-3-hydroxy-3-methylbutanamide

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSFERASE/TRANSFERASE INHIBITOR / KINASE DOMAIN / RECEPTOR / TRANSFERASE / TYROSINE-PROTEIN KINASE / TYROSINE KINASE INHIBITOR / TRANSFERASE-TRANSFERASE INHIBITOR COMPLEX / ANTI-ONCOGENE / CELL CYCLE / DISEASE / MUTATION / ATP-BINDING / NUCLEOTIDE-BINDING / GLYCOPROTEIN / PHOSPHOPROTEIN / MEMBRANE / SECRETED

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