{"title":"姜黄潜在化合物抗新冠肺炎作用的研究","authors":"D. Jini, R. Rajapaksha, S. Ariya, B. Joseph","doi":"10.3923/jps.2022.33.52","DOIUrl":null,"url":null,"abstract":"Background and Objective: COVID-19 is a new viral infectious disease caused by SARS-CoV-2 and there are no vaccines or drugs available to treat this deadly disease. Curcuma longa is a well-known medicinal plant with the antiviral property. So, the present study aims to evaluate the antiviral activity of phytocompounds from Curcuma longa against SARS-CoV-2. Materials and Methods: The phytocompounds from the Curcuma longa were docked with the main protease of SARS-CoV-2 (SARS-CoV-2 Mpro) by Autodock 4.2 to analyze the possibility of inhibiting the SARS-CoV-2 Mpro. Protein-ligand interaction profiler and ligplot+v.1.4.5 were used to analyze the interactions between the ligand and protein molecules. The toxicity and pharmacophore of the phytocompounds were determined by SWISSADME and PharmaGist web server.","PeriodicalId":16806,"journal":{"name":"Journal of Plant Sciences","volume":"605 1","pages":""},"PeriodicalIF":0.0000,"publicationDate":"2022-01-15","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Investigation on the Impact of Potential Phytocompounds from Curcuma longa Against COVID-19\",\"authors\":\"D. Jini, R. Rajapaksha, S. Ariya, B. Joseph\",\"doi\":\"10.3923/jps.2022.33.52\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"Background and Objective: COVID-19 is a new viral infectious disease caused by SARS-CoV-2 and there are no vaccines or drugs available to treat this deadly disease. Curcuma longa is a well-known medicinal plant with the antiviral property. So, the present study aims to evaluate the antiviral activity of phytocompounds from Curcuma longa against SARS-CoV-2. Materials and Methods: The phytocompounds from the Curcuma longa were docked with the main protease of SARS-CoV-2 (SARS-CoV-2 Mpro) by Autodock 4.2 to analyze the possibility of inhibiting the SARS-CoV-2 Mpro. Protein-ligand interaction profiler and ligplot+v.1.4.5 were used to analyze the interactions between the ligand and protein molecules. The toxicity and pharmacophore of the phytocompounds were determined by SWISSADME and PharmaGist web server.\",\"PeriodicalId\":16806,\"journal\":{\"name\":\"Journal of Plant Sciences\",\"volume\":\"605 1\",\"pages\":\"\"},\"PeriodicalIF\":0.0000,\"publicationDate\":\"2022-01-15\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Journal of Plant Sciences\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://doi.org/10.3923/jps.2022.33.52\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"\",\"JCRName\":\"\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of Plant Sciences","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.3923/jps.2022.33.52","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
引用次数: 0
摘要
背景与目的:COVID-19是由SARS-CoV-2引起的一种新型病毒性传染病，目前尚无疫苗或药物可用于治疗这种致命疾病。姜黄是一种具有抗病毒作用的知名药用植物。因此，本研究旨在评价姜黄植物化合物对SARS-CoV-2的抗病毒活性。材料与方法:采用Autodock 4.2软件将姜黄植物化合物与SARS-CoV-2主要蛋白酶(SARS-CoV-2 Mpro)对接，分析姜黄植物化合物抑制SARS-CoV-2 Mpro的可能性。使用蛋白质-配体相互作用分析器和ligplot+v.1.4.5分析配体与蛋白质分子之间的相互作用。通过SWISSADME和PharmaGist web server对化合物的毒性和药效进行了测定。
Investigation on the Impact of Potential Phytocompounds from Curcuma longa Against COVID-19
Background and Objective: COVID-19 is a new viral infectious disease caused by SARS-CoV-2 and there are no vaccines or drugs available to treat this deadly disease. Curcuma longa is a well-known medicinal plant with the antiviral property. So, the present study aims to evaluate the antiviral activity of phytocompounds from Curcuma longa against SARS-CoV-2. Materials and Methods: The phytocompounds from the Curcuma longa were docked with the main protease of SARS-CoV-2 (SARS-CoV-2 Mpro) by Autodock 4.2 to analyze the possibility of inhibiting the SARS-CoV-2 Mpro. Protein-ligand interaction profiler and ligplot+v.1.4.5 were used to analyze the interactions between the ligand and protein molecules. The toxicity and pharmacophore of the phytocompounds were determined by SWISSADME and PharmaGist web server.
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