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TitleStructure-activity relationship (SAR) studies on substituted N-(pyridin-3-yl)-2-amino-isonicotinamides as highly potent and selective glycogen synthase kinase-3 (GSK-3) inhibitors.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 81, Page 129143-129143, Year 2023
Publish dateJun 30, 2022 (structure data deposition date)
AuthorsLuo, G. / Chen, L. / Jacutin-Porte, S. / Han, Y. / Burton, C.R. / Xiao, H. / Krause, C.M. / Cao, Y. / Liu, N. / Kish, K. ...Luo, G. / Chen, L. / Jacutin-Porte, S. / Han, Y. / Burton, C.R. / Xiao, H. / Krause, C.M. / Cao, Y. / Liu, N. / Kish, K. / Lewis, H.A. / Macor, J.E. / Dubowchik, G.M.
External linksBioorg. Med. Chem. Lett. / PubMed:36669575
MethodsX-ray diffraction
Resolution2.205 Å
Structure data

PDB-8djd:
CRYSTAL STRUCTURE OF GLYCOGEN SYNTHASE KINASE 3 BETA COMPLEXED WITH 3-[(CYCLOPROPYLMETHYL)AMINO] -N-(4-PHENYLPYRIDIN-3-YL)IMIDAZO[1,2-B]PYRIDAZINE-8-CARBOX AMIDE
Method: X-RAY DIFFRACTION / Resolution: 2.205 Å

Chemicals

ChemComp-U3E:
2-[(cyclopropanecarbonyl)amino]-N-(5-phenylpyridin-3-yl)pyridine-4-carboxamide

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSFERASE/INHIBITOR / KINASE / GSK3B / TRANSFERASE-TRANSFERASE INHIBITOR complex / TRANSFERASE / TRANSFERASE-INHIBITOR complex

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