Comparative analyses of anti-inflammatory effects of Resveratrol, Pterostilbene and Curcumin: in-silico and in-vitro evidences.

In silico pharmacology Pub Date : 2024-05-02 eCollection Date: 2024-01-01 DOI:10.1007/s40203-024-00211-6
Rashmi Patil, Gaurang Telang, Urmila Aswar, Nishant Vyas
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Abstract

Inflammation is an adaptive response that involves activation, and recruitment of cells of innate and adaptive immune cells for restoring homeostasis. To safeguard the host from the threat of inflammatory agents, microbial invasion, or damage, the immune system activates the transcription factor NF-κB and produces cytokines such as TNF-α, IL- 6, IL-1β, and α. Sirtuin 1 (SIRT1) controls the increased amounts of proinflammatory cytokines, which in turn controls inflammation. Three phytoconstituents resveratrol (RES), pterostilbene (PTE), and curcumin (CUR) which are SIRT1- activators and that have marked anti-inflammatory effects (in-vivo), were chosen for the current study. These compounds were compared for their anti-inflammatory potential by in-silico docking studies for IL-6, TNF-α, NF-κB, and SIRT1 and in-vitro THP-1 cell line studies for IL-6, TNF-α. PTE was found to be more effective than RES and CUR in lowering the concentrations of IL-6 and TNF-α in THP-1 cell line studies, and it also showed a favorable docking profile with cytokines and SIRT1. Thus, PTE appears to be a better choice for further research and development as a drug or functional food supplement with the ability to reduce inflammation in metabolic disorders.

Graphical abstract: Schematic representation of in-silico and in-vitro analysis of Resveratrol, Pterostilbene, and Curcumin.

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白藜芦醇、紫檀芪和姜黄素抗炎作用的比较分析:硅内和体外证据。
炎症是一种适应性反应,包括先天性免疫细胞和适应性免疫细胞的激活和招募,以恢复体内平衡。为了保护宿主免受炎症因子、微生物入侵或损害的威胁,免疫系统会激活转录因子 NF-κB,并产生 TNF-α、IL- 6、IL-1β 和 α 等细胞因子。 Sirtuin 1(SIRT1)会控制促炎细胞因子的增加,进而控制炎症。本研究选择了三种植物成分白藜芦醇(RES)、紫檀芪(PTE)和姜黄素(CUR)作为 SIRT1 激活剂,它们具有明显的抗炎作用(体内)。通过对 IL-6、TNF-α、NF-κB 和 SIRT1 的体内对接研究以及对 IL-6、TNF-α 的体外 THP-1 细胞系研究,比较了这些化合物的抗炎潜力。在 THP-1 细胞系研究中,发现 PTE 在降低 IL-6 和 TNF-α 浓度方面比 RES 和 CUR 更有效,它还显示出与细胞因子和 SIRT1 的良好对接。因此,PTE 似乎是进一步研究和开发药物或功能性食品补充剂的更好选择,它具有降低代谢紊乱中炎症的能力。
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