Alignment-independent 3D-QSAR and molecular docking studies of tacrine-4-oxo-4H-Chromene hybrids as anti-Alzheimer's agents.

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作者： Elham,Manouchehrizadeh ^[1] ; Azar,Mostoufi ^[2] ; Elham,Tahanpesar ^[3] ; Masood,Fereidoonnezhad ^[4]

作者单位： Department of Chemistry, Khuzestan Science and Research Branch, Islamic Azad University, Ahvaz, Iran; Department of Chemistry, Ahvaz Branch, Islamic Azad University, Ahvaz, Iran. ^[1] Department of Chemistry, Ahvaz Branch, Islamic Azad University, Ahvaz, Iran; Marine Pharmaceutical Science Research Center, Ahvaz Jundishapur University of Medical Sciences, Ahvaz, Iran. Electronic address: mostoufi-a@ajums.ac.ir. ^[2] Department of Chemistry, Ahvaz Branch, Islamic Azad University, Ahvaz, Iran. ^[3] Department of Medicinal Chemistry, School of Pharmacy, Ahvaz Jundishapur University of Medical Sciences, Ahvaz, Iran. ^[4]

关键词 3D-QSAR AChE BuChE Molecular docking

主题词乙酰胆碱酯酶(Acetylcholinesterase);阿尔茨海默病(Alzheimer Disease);动物(Animals);苯吡喃类(Benzopyrans);丁酰胆碱酯酶(Butyrylcholinesterase);催化域(Catalytic Domain);胆碱酯酶抑制剂(Cholinesterase Inhibitors);药物设计(Drug Design);人类(Humans);分子结构(Molecular Structure);脑代谢改善药(Nootropic Agents);蛋白质结合(Protein Binding);量化构效关系(Quantitative Structure-Activity Relationship);他克林(Tacrine);电鳐(Torpedo)

DOI 10.1016/j.compbiolchem.2019.05.010

PMID 31170562

发布时间 2019-08-05

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Computational biology and chemistry

2019年80卷

463-471页

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Alignment-independent 3D-QSAR and molecular docking studies of tacrine-4-oxo-4H-Chromene hybrids as anti-Alzheimer's agents.

Computational biology and chemistry

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Computational biology and chemistry

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Alignment-independent 3D-QSAR and molecular docking studies of tacrine-4-oxo-4H-Chromene hybrids as anti-Alzheimer's agents.

Computational biology and chemistry

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Computational biology and chemistry

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