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TitleTarget-Based Identification and Optimization of 5-Indazol-5-yl Pyridones as Toll-like Receptor 7 and 8 Antagonists Using a Biochemical TLR8 Antagonist Competition Assay.
Journal, issue, pagesJ. Med. Chem., Vol. 63, Page 8276-8295, Year 2020
Publish dateJan 15, 2020 (structure data deposition date)
AuthorsKnoepfel, T. / Nimsgern, P. / Jacquier, S. / Bourrel, M. / Vangrevelinghe, E. / Glatthar, R. / Behnke, D. / Alper, P.B. / Michellys, P.Y. / Deane, J. ...Knoepfel, T. / Nimsgern, P. / Jacquier, S. / Bourrel, M. / Vangrevelinghe, E. / Glatthar, R. / Behnke, D. / Alper, P.B. / Michellys, P.Y. / Deane, J. / Junt, T. / Zipfel, G. / Limonta, S. / Hawtin, S. / Andre, C. / Boulay, T. / Loetscher, P. / Faller, M. / Blank, J. / Feifel, R. / Betschart, C.
External linksJ. Med. Chem. / PubMed:32786235
MethodsX-ray diffraction
Resolution2.793 Å
Structure data

PDB-6ty5:
Crystal structure of human TLR8 in complex with Compound 11
Method: X-RAY DIFFRACTION / Resolution: 2.793 Å

Chemicals

ChemComp-NAG:
2-acetamido-2-deoxy-beta-D-glucopyranose

ChemComp-O0W:
5-methyl-7-(7-methyl-2-piperidin-4-yl-indazol-5-yl)furo[3,2-c]pyridin-4-one

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsIMMUNE SYSTEM / RNA recognition Leucine rich repeats Glycosylation Structure based drug design Immune System Innate immunity

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