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-Structure paper
タイトル | Discovery of (R,E)-N-(7-Chloro-1-(1-[4-(dimethylamino)but-2-enoyl]azepan-3-yl)-1H-benzo[d]imidazol-2-yl)-2-methylisonicotinamide (EGF816), a Novel, Potent, and WT Sparing Covalent Inhibitor of Oncogenic (L858R, ex19del) and Resistant (T790M) EGFR Mutants for the Treatment of EGFR Mutant Non-Small-Cell Lung Cancers. |
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ジャーナル・号・ページ | J. Med. Chem., Vol. 59, Page 6671-6689, Year 2016 |
掲載日 | 2015年12月16日 (構造データの登録日) |
![]() | Lelais, G. / Epple, R. / Marsilje, T.H. / Long, Y.O. / McNeill, M. / Chen, B. / Lu, W. / Anumolu, J. / Badiger, S. / Bursulaya, B. ...Lelais, G. / Epple, R. / Marsilje, T.H. / Long, Y.O. / McNeill, M. / Chen, B. / Lu, W. / Anumolu, J. / Badiger, S. / Bursulaya, B. / DiDonato, M. / Fong, R. / Juarez, J. / Li, J. / Manuia, M. / Mason, D.E. / Gordon, P. / Groessl, T. / Johnson, K. / Jia, Y. / Kasibhatla, S. / Li, C. / Isbell, J. / Spraggon, G. / Bender, S. / Michellys, P.Y. |
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手法 | X線回折 |
解像度 | 2.651 - 3.4 Å |
構造データ | ![]() PDB-5fed: ![]() PDB-5fee: ![]() PDB-5feq: |
化合物 | ![]() ChemComp-5X4: ![]() ChemComp-HOH: ![]() ChemComp-5XH: |
由来 |
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![]() | TRANSFERASE/TRANSFERASE INHIBITOR / Kinase / Inhibitor / Covalently-bound / TRANSFERASE-TRANSFERASE INHIBITOR complex / Covalently bound / T790M |