Mechanisms of indigo naturalis on treating ulcerative colitis explored by GEO gene chips combined with network pharmacology and molecular docking

被引:68
|
作者
Gu, Sizhen [1 ]
Xue, Yan [2 ]
Gao, Yang [1 ]
Shen, Shuyang [1 ]
Zhang, Yuli [1 ]
Chen, Kanjun [1 ]
Xue, Shigui [3 ]
Pan, Ji [3 ]
Tang, Yini [3 ]
Zhu, Hui [4 ]
Wu, Huan [1 ]
Dou, Danbo [1 ]
机构
[1] Shanghai Univ Tradit Chinese Med, Shuguang Hosp, Tradit Chinese Med Dept, 528 Zhang Heng Rd, Shanghai 201203, Peoples R China
[2] Shanghai Univ Tradit Chinese Med, Shuguang Hosp, Shis Ctr Orthoped & Traumatol, Shanghai 201203, Peoples R China
[3] Shanghai Univ Tradit Chinese Med, Shuguang Hosp, Digest Endoscopy Ctr, Shanghai 201203, Peoples R China
[4] Shanghai Univ Tradit Chinese Med, Shuguang Hosp, Emergency Dept, Shanghai 201203, Peoples R China
基金
中国国家自然科学基金;
关键词
INFLAMMATORY-BOWEL-DISEASE; ALTERNATIVE MEDICINE USE; CHINESE HERBAL MEDICINE; SULFATE-INDUCED COLITIS; TNBS-INDUCED COLITIS; BETA-SITOSTEROL; XILEI-SAN; QING-DAI; COMPLEMENTARY; EFFICACY;
D O I
10.1038/s41598-020-71030-w
中图分类号
O [数理科学和化学]; P [天文学、地球科学]; Q [生物科学]; N [自然科学总论];
学科分类号
07 ; 0710 ; 09 ;
摘要
Oral administration of indigo naturalis (IN) can induce remission in ulcerative colitis (UC); however, the underlying mechanism remains unknown. The main active components and targets of IN were obtained by searching three traditional Chinese medicine network databases such as TCMSP and five Targets fishing databases such as PharmMapper. UC disease targets were obtained from three disease databases such as DrugBank,combined with four GEO gene chips. IN-UC targets were identified by matching the two. A protein-protein interaction network was constructed, and the core targets were screened according to the topological structure. GO and KEGG enrichment analysis and bioGPS localization were performed,and an Herbs-Components-Targets network, a Compound Targets-Organs location network, and a Core Targets-Signal Pathways network were established. Molecular docking technology was used to verify the main compounds-targets. Ten core active components and 184 compound targets of IN-UC, of which 43 were core targets, were enriched and analyzed by bioGPS, GO, and KEGG. The therapeutic effect of IN on UC may involve activation of systemic immunity, which is involved in the regulation of nuclear transcription, protein phosphorylation, cytokine activity, reactive oxygen metabolism, epithelial cell proliferation, and cell apoptosis through Th17 cell differentiation, the Jak-STAT and IL-17 signaling pathways, toll-like and NOD-like receptors, and other cellular and innate immune signaling pathways. The molecular mechanism underlying the effect of IN on inducing UC remission was predicted using a network pharmacology method, thereby providing a theoretical basis for further study of the effective components and mechanism of IN in the treatment of UC.
引用
收藏
页数:17
相关论文
共 50 条
  • [21] Network Pharmacology-based and Molecular Docking Combined with GEO Gene Chips to Investigate the Potential Mechanism of Duhuo Jisheng Decoction against Rheumatoid Arthritis
    Yang, Zhao
    Yuan, Zhen-Zhen
    Ma, Xin-Long
    CURRENT COMPUTER-AIDED DRUG DESIGN, 2024, 20 (04) : 405 - 415
  • [22] Network pharmacology and molecular docking reveal potential mechanism of esculetin in the treatment of ulcerative colitis
    Cai, Ting
    Cai, Bin
    MEDICINE, 2023, 102 (45) : E35852
  • [23] Mechanisms of Compound Sophora flavescens (Kushen) Decoction for the Treatment of Ulcerative Colitis based on Network Pharmacology and Molecular Docking Technology
    Peng, Zijing
    Zheng, Zhuoling
    Gao, Min
    Qin, Li
    Xiong, Lixiong
    Li, Xiaoyan
    Xie, Jingwen
    CURRENT COMPUTER-AIDED DRUG DESIGN, 2022, 18 (03) : 228 - 239
  • [24] Mechanisms of JinHong Formula on treating sepsis explored by randomized controlled trial combined with network pharmacology
    Wu, Xinxin
    He, Chenming
    Liu, Changya
    Xu, Xiangru
    Chen, Caiyu
    Yang, Hongqiang
    Shi, Haimei
    Fei, Yuerong
    Sun, Yuting
    Zhou, Shuang
    Fang, Bangjiang
    JOURNAL OF ETHNOPHARMACOLOGY, 2023, 305
  • [25] Mechanisms of Rhizoma Coptidis against type 2 diabetes mellitus explored by network pharmacology combined with molecular docking and experimental validation
    An, Wenrong
    Huang, Yanqin
    Chen, Shouqiang
    Teng, Tao
    Shi, Yingning
    Sun, Zhenhai
    Xu, Yunsheng
    SCIENTIFIC REPORTS, 2021, 11 (01)
  • [26] Mechanisms underlying the therapeutic effects of Qingfeiyin in treating acute lung injury based on GEO datasets, network pharmacology and molecular docking
    Wang, Ying
    Yuan, Yuan
    Wang, Wenting
    He, Ying
    Zhong, Hong
    Zhou, Xiaoxia
    Chen, Yong
    Cai, Xin-Jun
    Liu, Li-qin
    COMPUTERS IN BIOLOGY AND MEDICINE, 2022, 145
  • [27] Network Pharmacology and Molecular Docking Analysis on Molecular Mechanism of Qingzi Zhitong Decoction in the Treatment of Ulcerative Colitis
    Shou, Xintian
    Wang, Yumeng
    Zhang, Xuesong
    Zhang, Yanju
    Yang, Yan
    Duan, Chenglin
    Yang, Yihan
    Jia, Qiulei
    Yuan, Guozhen
    Shi, Jingjing
    Shi, Shuqing
    Cui, Hanming
    Hu, Yuanhui
    FRONTIERS IN PHARMACOLOGY, 2022, 13
  • [28] Mechanisms of Rhizoma Coptidis against type 2 diabetes mellitus explored by network pharmacology combined with molecular docking and experimental validation
    Wenrong An
    Yanqin Huang
    Shouqiang Chen
    Tao Teng
    Yingning Shi
    Zhenhai Sun
    Yunsheng Xu
    Scientific Reports, 11
  • [29] Identifying the Mechanisms and Molecular Targets of Guchang Zhixie Pills on Ulcerative Colitis: Coupling Network Pharmacology with GEO Database and Experiment Verification
    Wang, Weihao
    Song, Xujiao
    Ding, Shanshan
    Chen, Chunlin
    Ma, Hao
    COMBINATORIAL CHEMISTRY & HIGH THROUGHPUT SCREENING, 2023, 26 (11) : 2039 - 2056
  • [30] Mechanism of Jiawei Zhengqi Powder in the Treatment of Ulcerative Colitis Based on Network Pharmacology and Molecular Docking
    Zhao, Chao
    Zhi, ChenYang
    Zhou, JianHua
    BIOMED RESEARCH INTERNATIONAL, 2023, 2023