Tang Ning, Wang Yan, Miao Jiarui, Zhao Yang, Cao Yue, Sun Wentao, Zhang Jingke, Sui Hua, Li Bing
Department of Integrative Medicine, Liaoning University of Traditional Chinese Medicine Xinglin College, Shenyang, China.
Department of Integrative Medicine, Dalian Medical University, Dalian, China.
Front Pharmacol. 2024 Mar 11;15:1363415. doi: 10.3389/fphar.2024.1363415. eCollection 2024.
Tanshinone IIA (Tan-IIA) is the main bioactive component of Chinese herbal medicine salvia miltiorrhiza (Danshen). Sodium sulfonate of Tan-IIA is widely used in the treatment of cardiovascular and cerebrovascular diseases. Tan-IIA also has inhibitory effects on tumor cells such as gastric cancer, but its therapeutic effect and mechanism on human neuroblastoma have not been evaluated, so its pharmacological mechanism is systematically evaluated by the combined method of network pharmacology and molecular docking. PharmMapper and SwissTargetPrediction predicted 331 potential Tan-IIA-related targets, and 1,152 potential neuroblastoma-related targets were obtained from GeneCards, DisGeNET, DrugBank, OMIM and Therapeutic Target databases (TTD), 107 common targets for Tan-IIA and neuroblastoma. Through gene ontology (GO) functional annotation, Kyoto Encyclopedia of Genes and Genomesa (KEGG) pathway enrichment, protein-protein interaction (PPI) network and cytoHubba plug-in, 10 related signal pathways (Pathways in cancer, PI3K-Akt signaling pathway, Prostate cancer, etc.) and 10 hub genes were identified. The results of molecular docking showed that Tan-IIA could interact with 10 targets: GRB2, SRC, EGFR, PTPN1, ESR1, IGF1, MAPK1, PIK3R1, AKT1 and IGF1R. This study analyzed the related pathways and targets of Tan-IIA in the treatment of human neuroblastoma, as well as the potential anticancer and anti-tumor targets and related signaling pathways of Tan-IIA, which provides a reference for us to find and explore effective drugs for the treatment of human neuroblastoma.
丹参酮IIA(Tan-IIA)是中药材丹参的主要生物活性成分。丹参酮IIA磺酸钠广泛应用于心脑血管疾病的治疗。Tan-IIA对胃癌等肿瘤细胞也有抑制作用,但其对人神经母细胞瘤的治疗作用及机制尚未评估,因此采用网络药理学和分子对接相结合的方法对其药理机制进行系统评价。PharmMapper和SwissTargetPrediction预测了331个潜在的Tan-IIA相关靶点,从GeneCards、DisGeNET、DrugBank、OMIM和治疗靶点数据库(TTD)中获得了1152个潜在的神经母细胞瘤相关靶点,Tan-IIA与神经母细胞瘤的共同靶点有107个。通过基因本体(GO)功能注释、京都基因与基因组百科全书(KEGG)通路富集、蛋白质-蛋白质相互作用(PPI)网络和cytoHubba插件,确定了10条相关信号通路(癌症通路、PI3K-Akt信号通路、前列腺癌等)和10个核心基因。分子对接结果表明,Tan-IIA可与GRB2、SRC、EGFR、PTPN1、ESR1、IGF1、MAPK1、PIK3R1、AKT1和IGF1R这10个靶点相互作用。本研究分析了Tan-IIA治疗人神经母细胞瘤的相关通路和靶点,以及Tan-IIA潜在的抗癌和抗肿瘤靶点及相关信号通路,为寻找和探索治疗人神经母细胞瘤的有效药物提供参考。