Title : 4D-QSAR Molecular Modeling and Analysis of Flavonoid Derivatives as Acetylcholinesterase Inhibitors.

Pub. Date : 2021

PMID : 34193695






6 Functional Relationships(s)
Download
Sentence
Compound Name
Protein Name
Organism
1 Flavonoids are potential strikingly natural compounds with antioxidant activity and acetylcholinesterase (AChE) inhibitory activity for treating Alzheimer"s disease (AD). Flavonoids acetylcholinesterase (Cartwright blood group) Homo sapiens
2 Flavonoids are potential strikingly natural compounds with antioxidant activity and acetylcholinesterase (AChE) inhibitory activity for treating Alzheimer"s disease (AD). Flavonoids acetylcholinesterase (Cartwright blood group) Homo sapiens
3 In present study, in line with our interests in flavonoid derivatives as AChE inhibitors, a four-dimensional quantitative structure-activity relationship (4D-QSAR) molecular model was proposed. Flavonoids acetylcholinesterase (Cartwright blood group) Homo sapiens
4 The molecular docking analysis was also carried out to understand exceedingly the interactions between flavonoids and the AChE targets, which was in good agreement with the 4D-QSAR model. Flavonoids acetylcholinesterase (Cartwright blood group) Homo sapiens
5 Based on the information provided by the 4D-QSAR model and molecular docking analysis, the idea for optimizing the structures of flavonoids as AChE inhibitors was put forward which maybe provide theoretical guidance for the research and development of new AChE inhibitors. Flavonoids acetylcholinesterase (Cartwright blood group) Homo sapiens
6 Based on the information provided by the 4D-QSAR model and molecular docking analysis, the idea for optimizing the structures of flavonoids as AChE inhibitors was put forward which maybe provide theoretical guidance for the research and development of new AChE inhibitors. Flavonoids acetylcholinesterase (Cartwright blood group) Homo sapiens