{"title":"Network Pharmacology Reveals Curcuma aeruginosa Roxb. Regulates MAPK and HIF-1 Pathways to Treat Androgenetic Alopecia","authors":"Aaron Marbyn L. Sintos, Heherson S Cabrera","doi":"10.3390/biology13070497","DOIUrl":null,"url":null,"abstract":"Androgenetic alopecia (AGA) is the most prevalent hair loss disorder worldwide, driven by excessive sensitivity or response to androgen. Herbal extracts, such as Curcuma aeruginosa Roxb., have shown promise in AGA treatment due to their anti-androgenic activities and hair growth effects. However, the precise mechanism of action remains unclear. Hence, this study aims to elucidate the active compounds, putative targets, and underlying mechanisms of C. aeruginosa for the therapy of AGA using network pharmacology and molecular docking. This study identified 66 bioactive compounds from C. aeruginosa, targeting 59 proteins associated with AGA. Eight hub genes were identified from the protein–protein interaction network, namely, CASP3, AKT1, AR, IL6, PPARG, STAT3, HIF1A, and MAPK3. Topological analysis of components–targets network revealed trans-verbenol, myrtenal, carvone, alpha-atlantone, and isoaromandendrene epoxide as the core components with potential significance in AGA treatment. The molecular docking verified the binding affinity between the hub genes and core compounds. Moreover, the enrichment analyses showed that C. aeruginosa is involved in hormone response and participates in HIF-1 and MAPK pathways to treat AGA. Overall, this study contributes to understanding the potential anti-AGA mechanism of C. aeruginosa by highlighting its multi-component interactions with several targets involved in AGA pathogenesis.","PeriodicalId":504576,"journal":{"name":"Biology","volume":" 35","pages":""},"PeriodicalIF":0.0000,"publicationDate":"2024-07-04","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Biology","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.3390/biology13070497","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
引用次数: 0
Abstract
Androgenetic alopecia (AGA) is the most prevalent hair loss disorder worldwide, driven by excessive sensitivity or response to androgen. Herbal extracts, such as Curcuma aeruginosa Roxb., have shown promise in AGA treatment due to their anti-androgenic activities and hair growth effects. However, the precise mechanism of action remains unclear. Hence, this study aims to elucidate the active compounds, putative targets, and underlying mechanisms of C. aeruginosa for the therapy of AGA using network pharmacology and molecular docking. This study identified 66 bioactive compounds from C. aeruginosa, targeting 59 proteins associated with AGA. Eight hub genes were identified from the protein–protein interaction network, namely, CASP3, AKT1, AR, IL6, PPARG, STAT3, HIF1A, and MAPK3. Topological analysis of components–targets network revealed trans-verbenol, myrtenal, carvone, alpha-atlantone, and isoaromandendrene epoxide as the core components with potential significance in AGA treatment. The molecular docking verified the binding affinity between the hub genes and core compounds. Moreover, the enrichment analyses showed that C. aeruginosa is involved in hormone response and participates in HIF-1 and MAPK pathways to treat AGA. Overall, this study contributes to understanding the potential anti-AGA mechanism of C. aeruginosa by highlighting its multi-component interactions with several targets involved in AGA pathogenesis.
雄激素性脱发(AGA)是全球最普遍的脱发疾病,其原因是对雄激素过度敏感或反应过度。莪术等草药提取物具有抗雄激素活性和生发作用,因此在治疗雄激素性脱发方面前景看好。然而,其确切的作用机制仍不清楚。因此,本研究旨在利用网络药理学和分子对接,阐明莪术的活性化合物、假定靶点以及治疗 AGA 的潜在机制。本研究从铜绿微囊藻中发现了 66 种生物活性化合物,靶向 59 种与 AGA 相关的蛋白质。从蛋白质-蛋白质相互作用网络中发现了8个中心基因,即CASP3、AKT1、AR、IL6、PPARG、STAT3、HIF1A和MAPK3。成分-靶标网络拓扑分析表明,反式-verbenol、myrtenal、carvone、alpha-atlantone和isoaromandendrene epoxide是在AGA治疗中具有潜在意义的核心成分。分子对接验证了中心基因与核心化合物之间的结合亲和力。此外,富集分析表明铜绿微囊藻参与激素反应,并参与 HIF-1 和 MAPK 通路以治疗 AGA。总之,本研究强调了铜绿假单胞菌与 AGA 发病机制中多个靶点的多组分相互作用,有助于了解铜绿假单胞菌潜在的抗 AGA 机制。