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TitleImidazo[1,2-a]pyridine Derivatives as Aldehyde Dehydrogenase Inhibitors: Novel Chemotypes to Target Glioblastoma Stem Cells.
Journal, issue, pagesJ. Med. Chem., Vol. 63, Page 4603-4616, Year 2020
Publish dateJul 3, 2019 (structure data deposition date)
AuthorsQuattrini, L. / Gelardi, E.L.M. / Coviello, V. / Sartini, S. / Ferraris, D.M. / Mori, M. / Nakano, I. / Garavaglia, S. / La Motta, C.
External linksJ. Med. Chem. / PubMed:32223240
MethodsX-ray diffraction
Resolution3.25 Å
Structure data

PDB-6s6w:
Crystal Structure of human ALDH1A3 in complex with 2,6-diphenylimidazo[1,2-a]pyridine (compound GA11) and NAD+
Method: X-RAY DIFFRACTION / Resolution: 3.25 Å

PDB-6te5:
Crystal structure of human Aldehyde dehydrogenase 1A3 in complex with LQ43 inhibitor compound
Method: X-RAY DIFFRACTION / Resolution: 3.25 Å

Chemicals

ChemComp-NAD:
NICOTINAMIDE-ADENINE-DINUCLEOTIDE / NAD*YM

ChemComp-GOL:
GLYCEROL

ChemComp-KXT:
2,6-diphenylimidazo[1,2-a]pyridine

ChemComp-HOH:
WATER

ChemComp-N4Q:
6-(3,5-dimethoxyphenyl)-2-(4-methoxyphenyl)imidazo[1,2-a]pyridine

Source
  • homo sapiens (human)
KeywordsCYTOSOLIC PROTEIN / ALDH1A3 GA11 Glioma 2 / 6-diphenylimidazo[1 / 2-a]pyridine Retinaldehyde dehydrogenase inhinitor ALDHs / OXIDOREDUCTASE / Dehydrogenase isoenzyme ALDH1A3 Selective Inhibitor High grade Glioma

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