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TitleBicyclic pyrimidine compounds as potent IRAK4 inhibitors.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 73, Page 128900-128900, Year 2022
Publish dateJul 6, 2022 (structure data deposition date)
AuthorsChen, Y. / Tso, K. / Heckrodt, T.J. / Li, H. / Yen, R. / Lin, N. / Singh, R. / Taylor, V. / Masuda, E.S. / Park, G. / Payan, D.G.
External linksBioorg. Med. Chem. Lett. / PubMed:35863718
MethodsX-ray diffraction
Resolution2.45 Å
Structure data

PDB-8dks:
IRAK4 IN COMPLEX WITH COMPOUND #3
Method: X-RAY DIFFRACTION / Resolution: 2.45 Å

Chemicals

ChemComp-SO9:
(1S,2S,3R,4R)-3-({2-[3-(pyrrolidine-1-carbonyl)anilino]thieno[3,2-d]pyrimidin-4-yl}amino)bicyclo[2.2.1]hept-5-ene-2-carboxamide

ChemComp-BME:
BETA-MERCAPTOETHANOL

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsSIGNALING PROTEIN / kinase inhibitor / IRAK4 / pyrimidine / ATP binding / PROTEIN BINDING

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