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TitleMulti-target-directed ligands for treating Alzheimer's disease: Butyrylcholinesterase inhibitors displaying antioxidant and neuroprotective activities.
Journal, issue, pagesEur. J. Med. Chem., Vol. 156, Page 598-617, Year 2018
Publish dateDec 11, 2017 (structure data deposition date)
AuthorsKnez, D. / Coquelle, N. / Pislar, A. / Zakelj, S. / Jukic, M. / Sova, M. / Mravljak, J. / Nachon, F. / Brazzolotto, X. / Kos, J. ...Knez, D. / Coquelle, N. / Pislar, A. / Zakelj, S. / Jukic, M. / Sova, M. / Mravljak, J. / Nachon, F. / Brazzolotto, X. / Kos, J. / Colletier, J.P. / Gobec, S.
External linksEur. J. Med. Chem. / PubMed:30031971
MethodsX-ray diffraction
Resolution2.6 Å
Structure data

PDB-6f7q:
Human Butyrylcholinesterase complexed with N-Propargyliperidines
Method: X-RAY DIFFRACTION / Resolution: 2.6 Å

Chemicals

ChemComp-CWQ:
2-[[(3~{R})-1-(2,3-dihydro-1~{H}-inden-2-yl)piperidin-3-yl]methyl-(8-oxidanylquinolin-2-yl)carbonyl-amino]ethyl-dimethyl-azanium

ChemComp-GOL:
GLYCEROL

ChemComp-EDO:
1,2-ETHANEDIOL

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

ChemComp-SO4:
SULFATE ION

ChemComp-CL:
Unknown entry

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsHYDROLASE / Alzheimer disease AD butyrylcholinesterase N-Propargyliperidines

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