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徐长卿治疗银环蛇咬伤的网络药理学研究。

Network Pharmacological Study on the Mechanism of Cynanchum paniculatum (Xuchangqing) in the Treatment of Bungarus multicinctus Bites.

机构信息

Department of Emergency, Shenzhen Traditional Chinese Medicine Hospital, Shenzhen, China.

Department of Emergency, The Fourth Clinical Medical College of Guangzhou University of Chinese Medicine, Shenzhen, China.

出版信息

Biomed Res Int. 2022 Jul 5;2022:3887072. doi: 10.1155/2022/3887072. eCollection 2022.

Abstract

BACKGROUND

Bungarus multicinctus is one of the top ten venomous snakes in China. Its venom is mainly neurotoxin-based. Novel antivenom drugs need to be further researched and developed.

OBJECTIVE

This study aimed to explore the molecular mechanism of Cynanchum paniculatum in treating Bungarus multicinctus bites based on network pharmacology. . The potential active ingredients of Cynanchum paniculatum were screened and their SDF structures were obtained using the PubChem database and imported into the SwissTargetPrediction database, and targets were obtained for the antitoxin effects of Cynanchum paniculatum in the treatment of Bungarus multicinctus bites. The Cynanchum paniculatum-active compound-potential target network and protein-protein interaction network were constructed by using Cytoscape software, and then biological function analysis and KEGG pathway enrichment analysis were performed using the DAVID.

RESULTS

Seven potential active components (cynapanoside C, cynatratoside B, tomentolide A, sitosterol, sarcostin, tomentogenin, and paeonol) and 286 drug targets were obtained, including 30 key targets for the treatment of bungarotoxin toxicity. The active components mainly acted on PIK3CA, MAPK1, MAP2K1, JAK2, FYN, ACHE, CHRNA7, CHRNA4, and CHRNB2, and they antagonized the inhibitory effect of bungarotoxin on the nervous system through cholinergic synapses and the neurotrophin signaling pathway.

CONCLUSIONS

Cynanchum paniculatum exerts a therapeutic effect on Bungarus multicinctus bites through multiple active components, multiple targets, and multiple pathways. The findings provide a theoretical basis for the extraction of active components of Cynanchum paniculatum and for related antivenom experiments.

摘要

背景

银环蛇是中国十大毒蛇之一,其毒液主要以神经毒素为主,需要进一步研究开发新型抗蛇毒药物。

目的

本研究旨在基于网络药理学探讨徐长卿治疗银环蛇咬伤的分子机制。利用 PubChem 数据库筛选徐长卿的潜在活性成分,获取其 SDF 结构并导入 SwissTargetPrediction 数据库,获得徐长卿治疗银环蛇咬伤的抗毒作用靶点。采用 Cytoscape 软件构建徐长卿-活性成分-潜在靶点网络图和蛋白质-蛋白质相互作用网络,然后利用 DAVID 进行生物功能分析和 KEGG 通路富集分析。

结果

得到 7 个潜在活性成分(徐长卿苷 C、徐长卿苷 B、土莫昔林 A、β-谷甾醇、蛇根碱、薯蓣皂苷元、丹皮酚)和 286 个药物靶点,其中有 30 个关键靶点与治疗银环蛇毒素毒性有关。活性成分主要作用于 PIK3CA、MAPK1、MAP2K1、JAK2、FYN、ACHE、CHRNA7、CHRNA4、CHRNB2,通过胆碱能突触和神经营养因子信号通路拮抗银环蛇毒素对神经系统的抑制作用。

结论

徐长卿通过多种活性成分、多个靶点、多条途径对银环蛇咬伤发挥治疗作用,为徐长卿活性成分的提取及相关抗蛇毒实验提供了理论依据。

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