基于网络药理学探讨湖南省专家组推荐的新型冠状病毒肺炎中药预防用方二的预防机制

Network Pharmacology Approach to Investigate the Preventive Mechanism of Hunan Expert Group Recommended Chinese Medicine Prevention No. 2 Prescription Against COVID-19

  • 摘要:
    目的采用网络药理学方法探讨湖南省专家组推荐的新型冠状病毒肺炎中药预防用方二(以下简称“预防用方二”)可能的预防机制。
    方法通过检索TCMSP数据库筛选“预防用方二”中有效成分及其靶蛋白,利用Cytoscape 3.7.2构建“预防用方二”的“有效成分−靶点−疾病相互作用网络”,DAVID进行GO分析和KEGG的富集分析。
    结果通过TCMSP数据库药代动力学活性化合物条件筛选到复方中的163个化合物,278个目标蛋白靶点,调控网络中靶点最多的成分为山奈酚、汉黄芩素、7-甲氧基-2-甲基异黄酮、刺芒柄花素、异鼠李素、甘草查尔酮A等成分。GO富集分析结果显示“预防用方二”可以调控对炎症反应、病毒过程、体液免疫反应、对病毒的防御反应、病毒进入宿主细胞等生物过程,KEGG信号通路富集显示其可以调节NF- κ B信号通路、B细胞受体信号传导途径、病毒致癌作用、T细胞信号通路、Fc γ R介导的吞噬作用等信号通路。
    结论湖南省专家组推荐的新型冠状病毒肺炎中药预防用方二与免疫和炎症代谢关系最为密切,可能主要通过调控Toll样信号通路、T细胞信号通路、B细胞信号通路等多条信号通路途径发挥其防治作用;在抗流感病毒方面,其有效成分可能主要是通过调控机体免疫机制对密切接触人群起到预防效果。

     

    Abstract:
    ObjectiveTo explore the possible preventive mechanism of Hunan expert group recommended Chinese medicine prescription of No. 2 (Pre-No. 2) against coronavirus disease 2019 (COVID-19) by network pharmacology method.
    MethodsThe target proteins of effective components and active compounds in Pre-No. 2 were screened by searching the Tradi-tional Chinese Medicine Systems Pharmacology Database and Analysis Platform (TCMSP). A component-target-disease interac-tion network of Pre-No. 2 was constructed by Cytoscape 3.7.2, gene ontology (GO) analysis, and Kyoto encyclopedia of genes and genomes (KEGG) analysis of target protein pathway by DAVID.
    ResultsA total of 163 compounds and 278 target protein targets in Pre-No. 2 were collected from the TCMSP database. Kaempferol, wogonin, 7-methoxy-2-methyl isoflavone, formononetin, isorhamnetin, and licochalcone A were the most frequent targets in the regulatory network. GO enrichment analysis showed that Pre-No. 2 regulated response to virus, viral processes, humoral immune responses, defense responses to virus and viral entry into host cells. KEGG enrichment analysis showed that the formula regulated the NF-κB signaling pathway, B cell receptor signaling pathway, viral carcinogenesis, T cell signaling pathway and FcγR-mediated phagocytosis signaling pathway.
    ConclusionsPre-No. 2 may play a preventive role against COVID-19 through regulation of the Toll-like signaling, T cell signaling, B cell signaling and other signaling pathways. It may re-gulate the immune system to protect against anti-influenza virus.

     

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