针对人乳头瘤病毒 18 型 l1 蛋白的紫锥菊植物配体的硅学研究:对宫颈癌治疗的启示

Vinaya Vinod, Shinde, Sakshi Chaudhary, Parminder Kaur, Swati Bankariya
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引用次数: 0

摘要

目的:人类乳头瘤病毒(HPV)是一种高度致癌的病毒,是导致大多数上皮内病变和宫颈癌的罪魁祸首。在各种 HPV 类型中,16 和 18 型约占全球宫颈癌病例的 70%,是与该疾病相关的最普遍的高危致癌变体。许多疫苗(加卫苗 9、加卫苗和 Cervarix)已被美国食品及药物管理局批准用于抗击 HPV 感染;然而,由于其成本效益有限,疫苗的广泛实施面临挑战:方法:紫锥菊的成分已被用于针对 HPV 16 型 L1 蛋白的硅分析研究。在本分析中,我们旨在通过分子对接分析探讨紫锥菊植物配体(姜黄素、紫锥菊苷和菊苣酸)与 HPV 18 型(2R5I)的主要帽状蛋白 L1 之间的潜在相互作用:分子对接分析表明,紫锥菊成分之一的棘果苷与18型人乳头瘤病毒L1蛋白的结合亲和力最好(-7.9 kcaL/moL):分子对接分析表明,紫花酢浆草可作为人乳头瘤病毒感染的抑制剂。有必要开展进一步的研究和体内研究,以确认其作为现有人乳头瘤病毒疫苗的一种具有成本效益的替代品的功效。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
IN SILICO INVESTIGATION OF ECHINACEA PURPUREA PHYTO LIGANDS TARGETING HUMAN PAPILLOMAVIRUS TYPE 18’S L1 PROTEIN: IMPLICATIONS FOR CERVICAL CANCER MANAGEMENT
Objectives: Human papillomavirus (HPV) is a highly oncogenic virus responsible for the majority of intraepithelial lesions and cervical cancer. Among various HPV types, 16 and 18 contribute to approximately 70% of cervical cancer cases globally, making them the most prevalent high-risk oncogenic variants associated with this disease. Numerous vaccines (Gardasil 9, Gardasil, and Cervarix) have been approved by FDA to combat HPV infections; however, their widespread implementation faces challenges due to their limited cost-effectiveness. Methods: Echinacea purpurea’s components have already been studied for in silico analysis against HPV Type 16’s L1 protein. In the present analysis, we aimed to explore the potential interaction between E. purpurea phytoligands (curcumin, echinacoside, and chicoric acid) and the major capsid protein L1 of HPV type 18 (2R5I) through molecular docking analysis. Results: Molecular docking analysis revealed that the echinacoside, one of the components of E. purpurea, has the best binding affinity (−7.9 kcaL/moL) against the L1 protein of the HPV type 18. Conclusion: The molecular docking analysis indicates that E. purpurea could act as an inhibitor against HPV infection. Further research and in vivo studies are necessary to confirm its efficacy as a cost-effective alternative to present HPV vaccines.
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