FANG Liyuan, FENG Xue, LI Huijie, et al. Molecular Mechanism of Iphigenia Indica in the Treatment of Breast Cancer Based on Network Pharmacology. [J]. 21(11):1302-1307(2021)
DOI:
FANG Liyuan, FENG Xue, LI Huijie, et al. Molecular Mechanism of Iphigenia Indica in the Treatment of Breast Cancer Based on Network Pharmacology. [J]. 21(11):1302-1307(2021) DOI: 10.14009/j.issn.1672-2124.2021.11.005.
Molecular Mechanism of Iphigenia Indica in the Treatment of Breast Cancer Based on Network Pharmacology
摘要
目的:基于网络药理学-分子对接技术
探讨山慈菇治疗乳腺癌的分子作用机制。方法:从中药系统药理学数据库与分析平台(traditional Chinese medicine systems pharmacology database and analysis platform
TCMSP)和Uni Prot数据库中收集山慈菇的活性成分和其作用靶点
运用Gene Cards、人类孟德尔遗传综合数据库(online mendelian inheritance in man
OBJECTIVE: To explore the molecular mechanism of iphigenia indica in the treatment of breast cancer based on network pharmacology molecular docking. METHODS: The active components and their targets of iphigenia indica were collected from traditional Chinese medicine systems pharmacology database and analysis platform( TCMSP). The database of breast cancer target was established by GeneCards
online mendelian inheritance in man( OMIM) and comparative toxicogenomics database( CTD)
and the intersection target of iphigenia indica in the treatment of breast cancer was obtained. Cytoscape Version 3. 7. 1 software and STRING database were used to draw the network diagram of “iphigenia indica-active ingredients-targets ” and protein-protein interaction( PPI). Kyoto encyclopedia of genes and genomes( KEGG) pathway enrichment analysis and gene ontology( GO) functional enrichment analysis were performed by using R language package. Molecular docking was used to explore the interaction between active ingredients and core targets. Cell experiments were carried out to prove the inhibitory effect of the decoction on the proliferation of breast cancer cells. RESULTS: There were 3 active ingredients and 70 targets in iphigenia indica
including 364 targets in breast cancer. There were 14 targets in the intersection of iphigenia indica and breast cancer targets. Stigmasterol and beta-sitosterol were the most important ingredients of traditional Chinese medicine. The key targets were PTGS2
JUN
ESR1 and NOS3. Go analysis and KEGG enrichment analysis showed that 475 GO pathways and 23 KEGG pathways were screened out
mainly related to cancer pathway and estrogen signaling pathway. The results of molecular docking indicated that there was good binding energy between the compound and the target. Cell experiments confirmed that iphigenia indica has significant anti-tumor effect on breast cancer. CONCLUSIONS: Iphigenia indica has the characteristics of multi-component
multi-target and multi-channel in the treatment of breast cancer
which can provide more references for clinical application.
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Related Author
FANG Liyuan
LI Huijie
WANG Zhipeng
LI Xiurong
ZHANG Ning
GUO Yali
LIU Jian
PENG Yanru
Related Institution
First College of Clinical Medicine,Shandong University of Traditional Chinese Medicine
Dept.of Oncology,Affliated Hospital of Shandong University of Traditional Chinese Medicine
Dept. of Respiratory, Beijing Hospital of Traditional Chinese Medicine, Capital Medical University
College of the 1st Clinical Medical Sciences, Henan University of Chinese Medicine
Dept.of Gynaecology and Obstetrics, the First Affiliated Hospital of Henan University of Chinese Medicine