网络药理学探索揭示 niruri Phyllanthus 对非酒精性脂肪肝的分子影响:体外和硅学证据

Anuragh Singh, Vellapandian Chitra, K. Ilango
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引用次数: 0

摘要

代谢综合征的肝脏表现与 2 型糖尿病、胰岛素抵抗和高胆固醇等各种代谢疾病相关,被称为非酒精性脂肪肝(NAFLD)。尽管开展了多项研究工作,但目前尚无经批准的药物可用于治疗这种疾病。Swiss Target Prediction 被用来筛选植物化学物质。为了检查潜在的靶点,开发了蛋白质-蛋白质相互作用(PPI)网络。Cytoscape用于创建成分-靶标-途径(C-T-P)网络,AutoDock用于评估分子对接。体外测试了抗氧化性和抗炎性。发现柚皮苷、鞣花酸和青花素是主要的活性成分。作为重要靶标,PPARA、PPARG 和 AKT1 被选中。通过富集分析,共确定了 20 个关键信号通路,包括胰岛素抵抗(IR)、非酒精性脂肪肝、松弛素、PI3K-Akt、HIF-1、AGE-RAGE 和 MAPK。硅学计算技术预测了活性成分和疾病靶点的分子通路,从而有助于进一步的研究。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Network pharmacology exploration to reveal molecular insights of Phyllanthus niruri in non-alcoholic fatty liver: In vitro and in silico evidence
The hepatic manifestation of metabolic syndrome, associated with various metabolic diseases such as type 2 diabetes, insulin resistance, and high cholesterol, is called non-alcoholic fatty liver disease (NAFLD). Despite several research efforts, no approved medicine is currently available for the treatment of this illness. Swiss Target Prediction was used to screen phytochemicals. To examine potential targets, the protein-protein interaction (PPI) network was developed. Cytoscape was used to create the component-target-pathway (C-T-P) network, and AutoDock was used to assess molecular docking. Antioxidant and anti-inflammatory qualities were tested in vitro. Naringenin, ellagic acid, and cyanidin were found to be the main active components. As important targets, PPARA, PPARG, and AKT1 were selected. Through enrichment analysis, a total of 20 crucial signaling pathways, including insulin resistance (IR), NAFLD, relaxin, PI3K-Akt, HIF-1, AGE-RAGE, and MAPK, were identified. The in silico computational techniques predicted the molecular pathway for the active ingredients and the disease targets, thus helping to further research.
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