In Silico Phytochemical Screening for Hantavirus

Aishwarya Nair, Aleena Stanley, Ayswarya Kiren, Saniga Geo Cheruvathoor
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Abstract

Several rodent species are carriers of hantavirus which are present throughout the world. Hantavirus was a group of unknown class of viruses which was first seen in the United States of America in 1993 as  an acute respiratory disease now termed hantavirus pulmonary syndrome (HPS). Earlier  HPS hantavirus were known as the agents of hemorrhagic fever with renal syndrome which was seen in eastern hemisphere of the world .A lot of research is going around in and around hantavirus Their ubiquity and potential for causing severe human illness make these viruses an important public health concern.We present a docking based screening using a quantum mechanical  scoring of a library built from approved drugs and compound that limonin ,curcumin, luteolin, rutin, Baicalin, Quercetin, Resveratrol, Kaempferol, Naringenin, Atropine, 4 Hydroxy Coumarin, Colchicine, Thymoquinone, Glabridin ,Hypericin, Lycorine with proteins having PDB id’s 5E04 and 5E05 could display that the phytochemicals can act against Hantavirus. We hope that our findings may contribute to rational drug design against Hantavirus.
汉坦病毒的硅片植物化学筛选
几种啮齿类动物是汉坦病毒的携带者,这种病毒存在于世界各地。汉坦病毒是一组未知类别的病毒,于1993年在美利坚合众国首次发现,当时是一种急性呼吸道疾病,现在称为汉坦病毒肺综合征。早期的HPS汉坦病毒被认为是引起肾综合征出血热的病原体这在东半球很常见,很多研究都是围绕汉坦病毒进行的它们的普遍存在和引起严重人类疾病的潜力使这些病毒成为一个重要的公共卫生问题。本文采用量子力学评分方法对已获批的药物和化合物库进行对接筛选,发现柠檬苦素、姜黄素、木犀草素、芦丁、黄芩苷、槲皮素、白藜芦醇、山奈酚、柚皮素、阿托品、4羟基香豆素、秋水仙素、百里醌、光甘草定、金丝桃素、石蒜碱与PDB id为5E04和5E05的蛋白具有抗汉坦病毒的作用。我们希望我们的发现可以为汉坦病毒的合理药物设计做出贡献。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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