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基于网络药理学方法的复方丹参治疗疼痛作用的药效学机制的生物信息学研究。

A bioinformatics investigation into the pharmacological mechanisms of the effect of Fufang Danshen on pain based on methodologies of network pharmacology.

机构信息

School of life sciences, Nanjing University, Nanjing, 210023, China.

出版信息

Sci Rep. 2019 Apr 11;9(1):5913. doi: 10.1038/s41598-019-40694-4.

Abstract

Fufang Danshen (FFDS), a Chinese medicine formula widely used in the clinic, has proven therapeutic effects on pain relief. However, the mechanisms of these effects have not been elucidated. Here, we performed a systematic analysis to discover the mechanisms of FFDS in attenuating pain to gain a better understanding of FFDS in the treatment of other diseases accompanied by pain. Relevance analysis showed that Salvia miltiorrhizae was the best studied herb in FFDS. Most compounds in FFDS have good bioavailability, and we collected 223 targets for 35 compounds in FFDS. These targets were significantly enriched in many pathways related to pain and can be classified as signal transduction, endocrine system, nervous system and lipid metabolism. We compared Salvia miltiorrhizae and Panax notoginseng and found that they can significantly affect different pathways. Moreover, ten pain disease proteins and 45 therapeutic targets can be directly targeted by FFDS. All 45 therapeutic targets have direct or indirect connections with pain disease proteins. Forty-six pain disease proteins can be indirectly affected by FFDS, especially through heat shock cognate 71 kDa protein (HSPA8) and transcription factor AP-1 (JUN). A total of 109 targets of FFDS were identified as significant targets.

摘要

复方丹参(FFDS)是一种广泛应用于临床的中药方剂,已被证明具有缓解疼痛的治疗作用。然而,其作用机制尚未阐明。在这里,我们进行了系统分析,以发现 FFDS 缓解疼痛的作用机制,从而更好地了解 FFDS 在治疗其他伴有疼痛的疾病中的作用。相关性分析表明,丹参是 FFDS 中研究最多的草药。FFDS 中的大多数化合物具有良好的生物利用度,我们收集了 FFDS 中 35 种化合物的 223 个靶点。这些靶点显著富集在与疼痛相关的许多途径中,可分为信号转导、内分泌系统、神经系统和脂质代谢。我们比较了丹参和三七,发现它们可以显著影响不同的途径。此外,10 种疼痛疾病蛋白和 45 种治疗靶点可以被 FFDS 直接靶向。所有 45 个治疗靶点与疼痛疾病蛋白直接或间接相关。46 种疼痛疾病蛋白可间接受到 FFDS 的影响,尤其是通过热休克同源 71kDa 蛋白(HSPA8)和转录因子 AP-1(JUN)。FFDS 的 109 个靶点被确定为显著靶点。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/0ce7/6459854/8b8ab3d9a87a/41598_2019_40694_Fig1_HTML.jpg

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