2. Academic Validation
  3. Investigation on the mechanism of 2,3,4',5-Tetrahydroxystilbene 2-o-D-glucoside in the treatment of inflammation based on network pharmacology

Investigation on the mechanism of 2,3,4',5-Tetrahydroxystilbene 2-o-D-glucoside in the treatment of inflammation based on network pharmacology

  • Comput Biol Med. 2022 Jun:145:105448. doi: 10.1016/j.compbiomed.2022.105448.
Ling Sun 1,  Bixu Wang 2,  Tong Sun 3,  Fangmei Zhou 4,  Bingqi Zhu 5,  Chang Li 6,  Haitong Wan 7,  Zhishan Ding 8
Affiliations

Affiliations

  • 1 School of Medical Technology and Information Engineering, Zhejiang Chinese Medical University, Hangzhou, 310053, Zhejiang, People's Republic of China. Electronic address: Lingsunrise@163.com.
  • 2 School of Medical Technology and Information Engineering, Zhejiang Chinese Medical University, Hangzhou, 310053, Zhejiang, People's Republic of China. Electronic address: wbxmust@163.com.
  • 3 School of Medical Technology and Information Engineering, Zhejiang Chinese Medical University, Hangzhou, 310053, Zhejiang, People's Republic of China. Electronic address: 1310239694@qq.com.
  • 4 School of Medical Technology and Information Engineering, Zhejiang Chinese Medical University, Hangzhou, 310053, Zhejiang, People's Republic of China. Electronic address: zfm1213@163.com.
  • 5 School of Medical Technology and Information Engineering, Zhejiang Chinese Medical University, Hangzhou, 310053, Zhejiang, People's Republic of China. Electronic address: bingqizhu@163.com.
  • 6 Institute of Cardio-cerebrovascular Disease, Zhejiang Chinese Medical University, Hangzhou, 310053, Zhejiang, People's Republic of China. Electronic address: 20171043@zcmu.edu.cn.
  • 7 Institute of Cardio-cerebrovascular Disease, Zhejiang Chinese Medical University, Hangzhou, 310053, Zhejiang, People's Republic of China. Electronic address: whtong@126.com.
  • 8 School of Medical Technology and Information Engineering, Zhejiang Chinese Medical University, Hangzhou, 310053, Zhejiang, People's Republic of China. Electronic address: dzszjtcm@163.com.
PMID: 35364310 DOI: 10.1016/j.compbiomed.2022.105448
Abstract

Background: Inflammation is the pathogenesis of various chronic diseases plaguing clinic for years.Fallopia multiflora (Thunb.) is a traditional Chinese herbal medicine with a long history of application in detoxification and anti-inflammation. 2,3,4',5-Tetrahydroxystilbene 2-o-D-glucoside (TSG) is a main active compound of F. multiflora. However, the mechanism of TSG in the treatment of inflammation remains unknown.

Methods: Network pharmacology and molecular docking were employed to explore the mechanism of anti-inflammatory effect of TSG. Potential targets of TSG and inflammation were obtained from Swiss Target Prediction, Pharm Mapper, and GeneCards database. Protein-protein interaction (PPI) networks, GO and KEGG pathway enrichment analysis were performed to elucidate the interaction of targets. Moreover, the anti-inflammatory effect of TSG was validated by in vitro experiments using flow cytometry, RT-qPCR, Western blot, and immunocytochemistry assays.

Results: PPI network and gene enrichment analysis showed that TSG may exert a protein kinase binding activity, and IKBKB, MAPK1, NFKBIA, and RELA were predicted as the targets of anti-inflammation. Verified by molecular docking and Western blot, TSG may target NF-κB and ERK2 related signals to alleviate inflammatory damage. Furthermore, TSG effectively downregulated the expression of inflammatory cytokine, the nuclear translocation of NF-κB p65, and the production of Reactive Oxygen Species (ROS).

Conclusion: TSG possesses significant anti-inflammatory effect. TSG may display a protein kinase binding activity and target NF-κB and ERK2 related signals to treat the inflammation. This work may enlighten the potential application of TSG in anti-inflammation and indicate network pharmacology was an effective tool for the further study of TCM.

Keywords

2,3,4′,5-Tetrahydroxystilbene 2-o-D-glucoside; Inflammation; LPS; Molecular docking; NF-κB/ERK2; Network pharmacology; RAW264.7cells.

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