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TitleDiscovery of Potent Benzolactam IRAK4 Inhibitors with Robust in Vivo Activity.
Journal, issue, pagesAcs Med. Chem. Lett., Vol. 11, Page 327-333, Year 2020
Publish dateNov 12, 2019 (structure data deposition date)
AuthorsRajapaksa, N.S. / Gobbi, A. / Drobnick, J. / Do, S. / Kolesnikov, A. / Liang, J. / Chen, Y. / Sujatha-Bhaskar, S. / Huang, Z. / Brightbill, H. ...Rajapaksa, N.S. / Gobbi, A. / Drobnick, J. / Do, S. / Kolesnikov, A. / Liang, J. / Chen, Y. / Sujatha-Bhaskar, S. / Huang, Z. / Brightbill, H. / Francis, R. / Yu, C. / Choo, E.F. / DeMent, K. / Ran, Y. / An, L. / Emson, C. / Maher, J. / Wai, J. / McKenzie, B.S. / Lupardus, P.J. / Zarrin, A.A. / Kiefer, J.R. / Bryan, M.C.
External linksAcs Med. Chem. Lett. / PubMed:32184965
MethodsX-ray diffraction
Resolution1.74 Å
Structure data

PDB-6uya:
Crystal structure of Compound 19 bound to IRAK4
Method: X-RAY DIFFRACTION / Resolution: 1.74 Å

Chemicals

ChemComp-QL7:
N-{2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-(morpholin-4-yl)-1-oxo-2,3-dihydro-1H-isoindol-5-yl}pyrazolo[1,5-a]pyrimidine-3-carboxamide

ChemComp-SO4:
SULFATE ION

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsSIGNALING PROTEIN/INHIBITOR / kinase / inflammation / lupus / immunology / inhibitor / cancer / SIGNALING PROTEIN / SIGNALING PROTEIN-INHIBITOR complex

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