目的 运用网络药理学及分子对接技术研究蜈蚣抗胶质母细胞瘤的多成分、多靶点、多通路作用机制。方法 通过BATMAN-TCM、HERB数据库以及文献查找获得蜈蚣的相关成分，并通过SwissTargetPrediction预测靶点；在GeneCards、OMIM、TTD数据库查找获得胶质母细胞瘤的相关靶点；将二者汇总去重后取交集得到蜈蚣抗胶质母细胞瘤的潜在靶点。将交集基因导入STRING进行蛋白相互作用（PPI）分析后生成PPI网络图，用Cytoscape进行网络拓扑分析，并利用CytoNCA插件确定核心靶点和核心药物成分，并做“药物–成分–靶点”图。在DAVID数据库开展基因本体（GO）生物功能及京都基因与基因组百科全书（KEGG）通路富集分析，用Cytoscape绘制“药物成分–疾病靶点–通路”图。通过AutoDock Vina进行分子对接验证。结果 筛选出蜈蚣有效成分46个，靶点708个。胶质母细胞瘤靶点2 151个，得到180个交集基因。GO富集分析得到997个条目，153个KEGG富集分析通路，主要涉及癌症途径、细胞凋亡、磷脂酰肌醇3-激酶（PI3K）/蛋白激酶B1（Akt）信号通路、肿瘤坏死因子信号通路和ErbB信号通路等。通过CytoNCA分析筛选出Akt1、致癌转录因子信号转导和转录激活因子3（STAT3）、表皮生长因子受体（EGFR）、转录因子（JUN）、原癌基因酪氨酸蛋白激酶（Src）等可能为核心靶点，环(L-苯丙-L-酪)二肽、环(L-苯丙-L-脯)二肽、环(L-缬-L-脯)二肽、N-乙酰基-2-苯基乙胺、环(L-亮-L-脯)二肽等可能为蜈蚣抗胶质母细胞瘤的核心成分。分子对接验证得出，核心成分与核心靶点均能较好结合。结论 蜈蚣抗胶质母细胞瘤涉及环(L-苯丙-L-酪)二肽、环(L-苯丙-L-脯)二肽、环(L-缬-L-脯)二肽、N-乙酰基-2-苯基乙胺、环(L-亮-L-脯)二肽，Akt1、STAT3、EGFR、JUN、Src和PI3K/Akt信号通路、肿瘤坏死因子信号通路和ErbB信号通路等多成分、多靶点、多通路途径。

Objective To investigate the multi-component, multi-target, and multi-pathway mechanism of Scolopendra subspinipes mutilans in treating glioblastoma by using network pharmacology and molecular docking technology. Methods The related components of Scolopendra subspinipes mutilans were obtained through BATMAN-TCM, HERB databases and literature search, and the targets were predicted by SwissTargetPrediction. The related targets of glioblastoma were obtained from GeneCards, OMIM, and TTD databases. The potential targets of Scolopendra subspinipes mutilans in treating glioblastoma were obtained by summarizing and removing duplicates of the two. The intersection genes were imported into STRING for PPI analysis to generate a PPI network diagram, and network topology analysis was performed using Cytoscape. The core targets and core drug components were determined using the CytoNCA plugin, and a “drug – component-target” diagram was made. GO biological function and KEGG pathway enrichment analysis were conducted in the DAVID database, and a “drug component-disease target-pathway” diagram was drawn using Cytoscape. Molecular docking verification was then performed using AutoDock Vina. Results There were 46 effective components of centipedes and 708 targets were screened out. There were 2 151 targets of glioblastoma, and 180 intersection genes were obtained. GO enrichment analysis yielded 997 items, and 153 KEGG enrichment analysis pathways were obtained, mainly involving cancer pathways, apoptosis, PI3K/Akt signaling pathway, TNF signaling pathway, and ErbB signaling pathway, etc. Through CytoNCA analysis, Akt1, STAT3, EGFR, JUN, Src were screened out as possible core targets, and cyclo-(L-Phe-L-Tyr), cyclo-(L-Phe-L-Pro), cyclo-(L-Val-L-Pro), N-(2-phenylethyl) acetamide, cyclo-(L-Leu-L-Pro) were screened out as possible core components of Scolopendra subspinipes mutilans in treating glioblastoma. Molecular docking verification showed that the core components and core targets could bind well. Conclusion Scolopendra subspinipes mutilans in treating glioblastoma involves cyclo-(L-Phe-L-Tyr), cyclo-(L-Phe-L-Pro), cyclo-(L-Val-L-Pro), N-(2-phenylethyl) acetamide, cyclo-(L-Leu-L-Pro), Akt1, STAT3, EGFR, JUN, Src, and PI3K/Akt, TNF, and ErbB signaling pathways through multi-component, multi-target, and multi-pathway approaches.

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国家自然科学基金面上项目（82274498）；中央引导地方科技发展资金项目（YDZJSX2025D082）；山西省科技创新人才团队专项计划（202304051001046）；山西省中医药管理局中医药创新团队建设计划（zyytd2024007）；山西省卫健委科研项目（2022082）