机构:[1] Guangzhou Univ Chinese Med, Inst Clin Med 2, Guangzhou, Guangdong, Peoples R China[2] Guangdong Prov Acad Chinese Med Sci, Guangzhou 510000, Guangdong, Peoples R China[3] Peking Univ, Coll Chem & Mol Engn, Beijing, Peoples R China
Objectives: Psoriasis vulgaris is a chronic inflammatory and immune-mediated skin disease. 44 metabonomics biomarkers were identified by high-throughput liquid chromatography coupled to mass spectrometry in our previous work, but the roles of metabonomics biomarkers in the pathogenesis of psoriasis is unclear. Methods: The metabonomics biomarker-enzyme network was constructed. The key metabonomics biomarkers and enzymes were screened out by network analysis. The binding affinity between each metabonomics biomarker and target was calculated by molecular docking. A binding energy-weighted polypharmacological index was introduced to evaluate the importance of target-related pathways. Results: long-chain fatty acids, phospholipids, Estradiol and NADH were the most important metabonomics biomarkers. Most key enzymes belonged hydrolase, thioesterase and acyltransferase. Six proteins (TNF-alpha, MAPK3, iNOS, eNOS, COX2 and mTOR) were extensively involved in inflammatory reaction, immune response and cell proliferation, and might be drug targets for psoriasis. PI3K-Akt signaling pathway and five other pathways had dose correlation with the pathogenesis of psoriasis and could deserve further research. Conclusions: The inflammatory reaction, immune response and cell proliferation are mainly involved in psoriasis. Network pharmacology provide a new insight into the relationships between metabonomics biomarkers and the pathogenesis of psoriasis.
基金:
Ministry of Science and Technology, ChinaMinistry of Science and Technology, China [2013BAI02B03]; Team project of Natural Science Foundation of Guangdong Province [S2013030011515]; Guangdong Science and Technology project [2016A020226010, 2017A020213011]; Special research on Chinese Medical Science and Technology of Guangdong Provincial Hospital of Chinese Medicine [YN2016MJ06]; Guangzhou University of Chinese Medicine [A1-AFD018161Z04]
第一作者机构:[1] Guangzhou Univ Chinese Med, Inst Clin Med 2, Guangzhou, Guangdong, Peoples R China[2] Guangdong Prov Acad Chinese Med Sci, Guangzhou 510000, Guangdong, Peoples R China
通讯作者:
通讯机构:[*1]Guangdong Prov Acad Chinese Med Sci, Guangzhou 510000, Guangdong, Peoples R China[2] Guangdong Prov Acad Chinese Med Sci, Guangzhou 510000, Guangdong, Peoples R China
推荐引用方式(GB/T 7714):
Gu Jiangyong,Li Li,Wang Dongmei,等.Deciphering metabonomics biomarkers-targets interactions for psoriasis vulgaris by network pharmacology[J].ANNALS OF MEDICINE.2018,50(4):323-332.