Molecular docking study on acetylcholinesterase and urease enzyme inhibition effects of Amygdalin

Z. Can, Y. Kara, Halil İbrahim Güler, C. Birinci, S. Kolaylı
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Abstract

This study investigated that the acetylcholinesterase, urease enzyme inhibition and these enzymes molecular docking as well as antioxidant activity of commercially available amygdalin. While Amygdalin displayed effect anti-urease activity compared to acetohydroxamic acid but, anti-acetylcholine esterase activity a little ineffective compared to donepezil. The molecular docking was performed in order to check binding interactions between the amygdalin and the enzymes. DPPH and FRAP assays were preferred to determine the antioxidant activity. The antioxidant activity (3.39±0.33 µmol Fe2SO47H2O /g, SC50 18.74±0.72 mg/mL using the FRAP and DPPH assays, respectively. Amygdalin's in vitro and in vivo studies are needed for demonstrated that is a therapeutic agent for the treatment of various diseases.
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乙酰胆碱酯酶和脲酶抑制作用的分子对接研究
本研究调查了市售苦杏仁苷对乙酰胆碱酯酶和脲酶的抑制作用、这些酶的分子对接以及抗氧化活性。与乙酰羟肟酸相比,苦杏仁苷显示出有效的抗脲酶活性,但与多奈哌齐相比,其抗乙酰胆碱酯酶活性略显不足。为了检查苦杏仁苷与酶之间的结合相互作用,进行了分子对接。DPPH 和 FRAP 试验是确定抗氧化活性的首选方法。使用 FRAP 和 DPPH 法测定的抗氧化活性分别为 3.39±0.33 µmol Fe2SO47H2O /g、SC50 18.74±0.72 mg/mL。需要对扁桃苷进行体外和体内研究,以证明它是治疗各种疾病的一种治疗剂。
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