茶树黄烷醇类化合物治疗阿尔茨海默病的分子对接与靶点研究

Nandhini Baskaran, Anitha Subash
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引用次数: 0

摘要

阿尔茨海默病是一种进行性神经退行性疾病,伴有神经精神症状和几种认知功能,其生化特征是脑神经递质乙酰胆碱显著减少。本研究利用Schrödinger软件(Maestro V: 11.8 Schrödinger_suite-2019)对接研究从茶树(绿茶)中鉴定的活性成分与乙酰胆碱酯酶(AChE)可能的相互作用。计算机实验结果清楚地表明儿茶素和表儿茶素-3-没食子酸酯通过强氢键与乙酰胆碱酯有效结合
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Molecular Docking and Therapeutic Targets of Flavanol Compounds from Camellia sinensis on Alzheimer’s Disease
Alzheimer’s disease is a progressive neurodegenerative disorder with neuropsychiatric symptoms and several cognitive functions and is biochemically characterized by a significant decrease in the brain neurotransmitter acetylcholine. The current study is performed to investigate possible interaction of the active components identified from Camellia sinensis (Green tea) with acetyl cholinesterase (AChE) through docking studies using Schrödinger software (Maestro V: 11.8 Schrödinger_suite-2019). In silico study results clearly showed that catechin and epicatechin-3-gallate binds effectively with AChE through strong hydrogen bonding
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