基于网络药理学和分子对接技术研究朱砂七治疗胃炎作用机制  

Research on the Mechanism of Cinnabar Seven in the Treatment of Gastritis Based on Network Pharmacology and Molecular Docking Technology

作　　者：韩小娟 程茜菲[1,2] 丁芳芳 刘斌[1,2] 李娟花[1] Han Xiaojuan;Cheng Qianfei;Ding Fangfang;Liu Bin;Li Juanhua(School of Pharmacy,Shaanxi Institute of International Trade&Commerce,Xi'am 712046,China;Collaborative Innovation Center of Green Manufacturing Technology for Traditional Chinese Medicine in Shanxi Province,Xi'an712046.China)

机构地区：[1]陕西国际商贸学院医药学院,陕西西安712046 [2]陕西省中药绿色制造技术协同创新中心,陕西西安712046

出　　处：《南开大学学报（自然科学版）》2022年第3期81-88,共8页Acta Scientiarum Naturalium Universitatis Nankaiensis

基　　金：陕西省教育厅2021年度一般专项科研计划项目(21JK0518);陕西省中药绿色制造技术协同创新中心培育项目(2019XT-3-04)。

摘　　要：基于网络药理学和分子对接技术探究朱砂七治疗胃炎(gastritis)的作用机制.利用TCMSP数据库,筛选朱砂七治疗胃炎的活性成分和潜在靶点;结合Genecards数据库挖掘治疗胃炎的相关靶点,对朱砂七与治疗胃炎的靶点进行PPI网络构建,交互处理得到朱砂七治疗胃炎的关键靶点,并进行GO分析和KEGG通路富集分析;并采用分子对接技术将主要活性成分与HIF1A、MYC、IL6、VEGFA、EGFR进行分子对接.最后利用吲哚美辛损伤GES-1细胞模型进行体外实验对结果加以验证.Based on network pharmacology and molecular docking technology,to explore the mechanism of zhushaqi in the treatment of gastritis.TCMSP database was used to screen the active components and potential targets of zhuashaqi in the treatment of gastritis.Combined with GeneCards database to mine the relevant targets for the treatment of gastritis,construct the PPI network between zhuashaqi and the targets for the treatment of gastritis,get the key targets of zhuashaqi for the treatment of gastritis through interactive processing,and conduct go analysis and KEGG pathway enrichment analysis.Molecular docking technology was used to dock the main active components with HIF1A,MYC,IL6,VEGFA and EGFR.Finally,the GES-1 cell model was injured by indomethacin in vitro to verify the results.

关 键 词：朱砂七 胃炎 网络药理学 分子对接 作用机制 

分 类 号：R285[医药卫生—中药学]