Jin Zhidie, Liu Mingwang, Xie Beili, Wen Wei, Yan Yuxin, Zhang Yangfang, Li Haohao, Shen ZhengYu, Jiang Lulian, Gao Mengjie, Chen Keji, Zhao Fuhai
Xiyuan Hospital, China Academy of Chinese Medical Sciences, Beijing, China.
Graduate School of Beijing University of Chinese Medicine, Beijing, China.
Front Pharmacol. 2024 Aug 30;15:1404874. doi: 10.3389/fphar.2024.1404874. eCollection 2024.
Microvascular angina (MVA) is the most common cause of cardiac ischemic chest pain in patients without obstructive coronary artery disease (CAD) and lacks of effective treatment means. Medicine food homology (MFH) involves substances with both nutritional and medicinal qualities that have the potential to improve MVA symptoms as medicines, dietary supplements. However, research on MFH formula (MFHF) for MVA is not available. The study aims to generate a core MFHF for MVA through data mining and offer scientific backing for the utilization of edible medications in the prevention and alleviation of MVA. 11 databases were utilized to construct a database of MFH drugs, and the MFHF was generated through frequency analysis, association rule analysis, and clustering analysis. The composition of the formula is Codonopsis Radix, Astragali Radix, Platycodonis Radix, Persicae Semen, Glycyrrhizae Radix Et Rhizoma, Angelicae Sinensis Radix, and Allii Macrostemonis Bulbus. Through network pharmacology and molecular docking, we identified five major active components of MFHF: Adenosine, Nonanoic Acid, Lauric Acid, Caprylic Acid, and Enanthic Acid, along with nine core targets (NFKB1, ALB, AKT1, ACTB, TNF, IL6, ESR1, CASP3, and PTGS) for the improvement of MVA. These 5 active components have various biological activities, such as reducing oxidative stress, anti-inflammation, analgesia effect, inhibiting platelet aggregation, vasodilatation, vascular endothelial protection, and cardio-protection. GO and KEGG enrichment analyses revealed that MFHF mainly acted on the response to xenobiotic stimulus, integrative component of the plasma membrane, RNA polymerase II transcription factor activity, ligand-activated sequence-specific DNA binding, pathways in cancer, lipid and atherosclerosis, human cytomegalovirus infection, and the PI3K-Akt signaling pathway, which are the main pathogenesis of MVA.
微血管性心绞痛(MVA)是无阻塞性冠状动脉疾病(CAD)患者心脏缺血性胸痛的最常见原因,且缺乏有效的治疗手段。药食同源(MFH)涉及兼具营养和药用特性的物质,这些物质有可能作为药物、膳食补充剂改善MVA症状。然而,尚无关于MVA的药食同源配方(MFHF)的研究。本研究旨在通过数据挖掘生成用于MVA的核心MFHF,并为食用药物在预防和缓解MVA中的应用提供科学依据。利用11个数据库构建药食同源药物数据库,并通过频率分析、关联规则分析和聚类分析生成MFHF。该配方的组成是党参、黄芪、桔梗、桃仁、甘草、当归和薤白。通过网络药理学和分子对接,我们确定了MFHF的五种主要活性成分:腺苷、壬酸、月桂酸、辛酸和庚酸,以及九个改善MVA的核心靶点(NFKB1、ALB、AKT1、ACTB、TNF、IL6、ESR1、CASP3和PTGS)。这5种活性成分具有多种生物学活性,如降低氧化应激、抗炎、镇痛作用、抑制血小板聚集、血管舒张、血管内皮保护和心脏保护作用。基因本体(GO)和京都基因与基因组百科全书(KEGG)富集分析表明,MFHF主要作用于对外源生物刺激的反应、质膜整合成分、RNA聚合酶II转录因子活性、配体激活的序列特异性DNA结合、癌症通路、脂质和动脉粥样硬化、人巨细胞病毒感染以及PI3K-Akt信号通路,这些都是MVA的主要发病机制。