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TitleOptimization Leading to a Potent and Selective Cbl‐b Inactive-State Inhibitor That Demonstrated In Vivo Efficacy.
Journal, issue, pagesAcs Med. Chem. Lett., Vol. 17, Page 1258-1265, Year 2026
Publish dateFeb 12, 2026 (structure data deposition date)
AuthorsLiang, J. / Lambrecht, M.J. / Huestis, M.P. / Zhu, B. / Barton, L.M. / Castanedo, G.M. / Ung, P.M. / Larouche-Gauthier, R. / Jakalian, A. / Leclerc, J.P. ...Liang, J. / Lambrecht, M.J. / Huestis, M.P. / Zhu, B. / Barton, L.M. / Castanedo, G.M. / Ung, P.M. / Larouche-Gauthier, R. / Jakalian, A. / Leclerc, J.P. / Yadav, A. / Haghshenas, P. / Aubert-Nicol, S. / Ismaili, H. / Zhao, L. / Leblanc, M. / de Almeida, H. / Wang, Q. / Garner, T. / Tan, S. / Prangley, M.S. / Pang, J. / Murray, J.M. / Yu, C. / Hsu, P.L. / Rutz, S. / Ishizuka, I. / Huang, H. / Gao, C. / Chen, M. / Mutter-Rottmayer, L. / Kakiuchi-Kiyota, S. / Leung, D.H. / Kou, P. / Bao, L. / Wang, X.
External linksAcs Med. Chem. Lett. / PubMed:42305193
MethodsX-ray diffraction
Resolution2.3 - 2.39 Å
Structure data

PDB-10ys:
Structure of Cbl-B bound to compound 33
Method: X-RAY DIFFRACTION / Resolution: 2.3 Å

PDB-10zf:
Structure of c-Cbl bound to compound 33
Method: X-RAY DIFFRACTION / Resolution: 2.39 Å

Chemicals

ChemComp-GOL:
GLYCEROL

ChemComp-IOD:
IODIDE ION

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-MG:
Unknown entry

ChemComp-ZN:
Unknown entry

PDB-1dcd:
DESULFOREDOXIN COMPLEXED WITH CD2+

ChemComp-DMS:
DIMETHYL SULFOXIDE / DMSO, precipitant*YM

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
  • schistosoma japonicum (invertebrata)
KeywordsLIGASE / Ubiquitin ligase / E3 / inhibitor

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