天然产物研究与开发 ›› 2020, Vol. 32 ›› Issue (10): 1674-1682.doi: 10.16333/j.1001-6880.2020.10.007

• 研究论文 • 上一篇    下一篇

连朴饮防治慢性萎缩性胃炎的作用机理研究

向阳1,2,3,戚璐1,吕文亮1*   

  1. 1湖北中医药大学,武汉 630065;2生物资源保护与利用湖北省重点实验室;3湖北民族大学医学部,恩施 445000

  • 出版日期:2020-10-28 发布日期:2020-10-29
  • 基金资助:
    生物资源保护与利用湖北省重点实验室开放基金(PKLHB1919)

Study on the mechanism of Lianpuyin in preventing and treating chronic atrophic gastritis

XIANG Yang1,2,3,QI Lu1,LYU Wen-liang1*   

  1. 1Hubei University of Traditional Chinese Medicine,Wuhan 630065,China;2Hubei Provincial Key Laboratory of Conservation and Utilization of Biological Resources;3Hubei Minzu University,Enshi 445000,China

  • Online:2020-10-28 Published:2020-10-29

摘要:

为探讨连朴饮防治慢性萎缩性胃炎“炎癌转化”的作用机理,在TCMSP数据库中检索获得连朴饮所有中药的活性成分、作用靶标及分子结构,建立数据集;通过GeneCard、OMIM数据库筛选慢性萎缩性胃炎疾病靶标,与连朴饮作用靶标取交集;利用Cytoscape软件构建中药成分-靶标-疾病网络及PPI网络,通过聚类分析获取核心成分与核心靶标;利用R(clusterProfiler包)对共有靶标进行GO、KEGG富集分析;利用AutodockTool、Vina软件将核心靶标与主要成分进行分子对接验证。经筛选获得连朴饮活性成分45种,靶标193个,疾病靶标686个,药物-疾病共有靶标81个;PPI及成分-靶标-疾病网络分析发现FOS、ICAM1、IL1B、IL6、IL10、CCL2、CXCL2、RELA、MAPK8、MAPK1、IFNG、CXCL8为核心靶标,山柰酚、黄芩苷元、β-谷甾醇、黄豆黄素、豆甾醇、槲皮素为连朴饮的主要活性成分;GO、KEGG富集分析发现连朴饮可能主要通过调节细胞因子受体结合、细胞因子活性、泛素样蛋白连接酶结合、受体配体活性、激酶调节活性等生物学过程,对慢性萎缩性胃炎发挥治疗作用,其机制可能主要涉及IL-17信号通路、Toll样受体信号通路、C型凝集素受体信号通路、Th17细胞分化信号通路等;分子对接结果显示连朴饮主要活性成分与慢病萎缩性胃炎核心靶标具有较强的结合性。研究表明连朴饮中多种活性成分可通过多种生物学过程作用于多种信号通路对慢性萎缩性“炎癌转化”发挥防治作用。

关键词: 连朴饮, 慢性萎缩性胃炎, 网络药理学, 分子对接, 机制, 治疗

Abstract:

To explore the mechanism of the prevention and treatment of Lianpuyin on the pathological of "inflammatory-cancer transformation" of chronic atrophic gastritis,we searched and got the active ingredients,targets and molecular of all traditional Chinese medicines in Lianpuyin from the TCMSP database,and set up a data set;Then,the disease targets of chronic atrophic gastritis were screened in the GeneCard and OMIM databases,and they were intersected with the target of Lianpuyin's traditional Chinese medicine ingredients;Using Cytoscape 3.6.2 software to build the "Chinese medicine component-target-disease" network and PPI network,and got the core ingredients and core targets through cluster analysis;Use R (clusterProfiler package) software to perform GO and KEGG enrichment analysis on common targets;and use AutodockTool and Vina software to perform molecular docking proof on core targets and core ingredients.The study found that Lianpuyin's traditional Chinese medicine contains 45 chemical active ingredients,193 targets,686 disease targets,and 81 drug-disease targets;Through PPI network and "component-target-disease" network analysis,FOS,ICAM1,IL1B,IL6,IL10,CCL2,CXCL2,RELA,MAPK8,MAPK1,IFNG,CXCL8 were found as core targets,and kaempferol,baicalein,β-sitosterol,glycitein,stigmasterol,quercetin are the main active ingredients of Chinese medicine contained in Lianpuyin;Through the enrichment analysis of GO and KEGG,it was found that Lianpuyin may mainly control chronic atrophy by regulating biological processes such as cytokine receptor binding,cytokine activity,ubiquitin-like protein ligase binding,receptor ligand activity,and kinase regulating activity.Gastritis plays a therapeutic role.The mechanism may mainly involve IL-17 signaling pathway,Toll-like receptor signaling pathway,C-type lectin receptor signaling pathway,Th17 cell differentiation signaling pathway,etc.;Finally,through molecular docking experiments,it was found that the main active ingredients contained in Lianpuyin traditional Chinese medicine have strong binding to the core target of chronic atrophic gastritis.Studies have shown that multiple active ingredients contained in Lianpuyin can act on multiple signaling pathways through various biological processes,and thus play a preventive and therapeutic role in the pathological process of "inflammatory-cancer transformation" of chronic atrophic gastritis.

Key words: Lianpuyin, chronic atrophic gastritis, network pharmacology, molecular docking, mechanism, treatment

中图分类号:  R285.5