Assessment of clot-lysing and membrane-stabilizing capacity of ascorbic acid: In vitro approach with molecular docking.

Q1 Environmental Science Toxicology Reports Pub Date : 2024-11-26 eCollection Date: 2024-12-01 DOI:10.1016/j.toxrep.2024.101831
Shuv Narayan Yadav, Md Sakib Al Hasan, Balaram Das, Md Shadin, Imam Hossen Rakib, Fazley Rohan, Siddique Akber Ansari, Irfan Aamer Ansari, Md Shimul Bhuia, Micheline Azevedo Lima, Carolina Bandeira Domiciano, Henrique Douglas Melo Coutinho, Muhammad Torequl Islam
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Abstract

This study aimed to evaluate the clot-lysing and membrane stabilizing capacities of ascorbic acid (AA) using in vitro and in silico methods. For this, we used in vitro clot lysis and hemolyzing tests to check the anti-atherothrombosis and membrane-stabilizing properties of AA, respectively. Additionally, molecular docking studies were performed to investigate AA's interactions with cyclooxygenase-1 (COX-1) and plasminogen enzymes. Findings suggest that AA exhibited a concentration-dependent effect, with 43.95 ± 1.27 % clot lysis and 64.46 ± 0.01 % membrane stabilization at 100 µg/mL. The IC50 values for clot lysis and membrane stabilization were 215.19 ± 1.09 and 57.21 ± 2.11 µg/mL, respectively. In silico analysis showed strong binding affinities of AA with COX-1 (-6.2 kcal/mol) and plasminogen (-5.8 kcal/mol), supporting its observed clot lysis and membrane protection activities. Taken together, AA showed moderate clot-lysing and robust membrane-stabilizing effects, which may be due to its strong antioxidant and anti-inflammatory properties. AA might be a good therapeutic agent for atherothrombosis and membrane damage, highlighting the need for further investigation into its underlying molecular mechanisms and potential clinical applications. AA shows promising clot-lysing and membrane-stabilizing effects, highlighting its therapeutic potential for atherothrombosis and membrane damage.

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本研究旨在利用体外和硅学方法评估抗坏血酸(AA)的凝血溶解和膜稳定能力。为此,我们使用体外血凝块裂解和溶血试验分别检测了抗坏血酸的抗动脉粥样硬化和膜稳定特性。此外,我们还进行了分子对接研究,以探讨 AA 与环氧合酶-1(COX-1)和纤溶酶的相互作用。研究结果表明,AA 具有浓度依赖性效应,在 100 µg/mL 浓度下,血块裂解率为 43.95 ± 1.27%,膜稳定性为 64.46 ± 0.01%。凝块溶解和膜稳定的 IC50 值分别为 215.19 ± 1.09 和 57.21 ± 2.11 µg/mL。硅学分析表明 AA 与 COX-1(-6.2 kcal/mol)和纤溶酶原(-5.8 kcal/mol)有很强的结合亲和力,支持其观察到的凝块溶解和膜保护活性。综上所述,AA 具有适度的凝块溶解和强大的膜稳定作用,这可能是由于它具有很强的抗氧化和抗炎特性。AA 可能是动脉粥样硬化血栓形成和膜损伤的良好治疗药物,因此需要进一步研究其潜在的分子机制和临床应用。AA具有良好的凝块溶解和膜稳定作用,突出了其治疗动脉粥样硬化血栓和膜损伤的潜力。
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来源期刊
Toxicology Reports
Toxicology Reports Environmental Science-Health, Toxicology and Mutagenesis
CiteScore
7.60
自引率
0.00%
发文量
228
审稿时长
11 weeks
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