CORONAVIRUS AND ITS MAIN PROTEASE: AN INSIGHT FOR DRUGS DESIGN BY MOLECULAR DOCKING

Detalhes bibliográficos
Autor(a) principal: Gonçalves, Simone Queiroga Brito
Data de Publicação: 2020
Outros Autores: da Silva Filho, Eloi Alves, de Oliveira, Osmair Vital, Gonçalves, Arlan da Silva
Tipo de documento: Artigo
Idioma: por
Título da fonte: Revista Eletrônica Debates em Educação Científica e Tecnológica
Texto Completo: https://ojs.ifes.edu.br/index.php/ric/article/view/749
Resumo: Many viruses need their sulphydryl groups to be reduced in order to be allowed to enter cells. SARS-CoV-2, which belongs to Coronaviridae family and is responsible for coronavirus disease 2019 or COVID-19, has cysteine-rich proteins in its capsid as the main CoV protease (MPRO), which must be intact and active maintaining the viral activity. Considering that MPRO is an important molecular target for development of antiviral drugs, this work motivation was the structural study of the possible ways of interaction between drugs and viral cysteines by molecular docking technique for design of new potential inhibitors of MPRO and its virulence.
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spelling CORONAVIRUS AND ITS MAIN PROTEASE: AN INSIGHT FOR DRUGS DESIGN BY MOLECULAR DOCKINGCoronavirusProteaseMolecular dockingMany viruses need their sulphydryl groups to be reduced in order to be allowed to enter cells. SARS-CoV-2, which belongs to Coronaviridae family and is responsible for coronavirus disease 2019 or COVID-19, has cysteine-rich proteins in its capsid as the main CoV protease (MPRO), which must be intact and active maintaining the viral activity. Considering that MPRO is an important molecular target for development of antiviral drugs, this work motivation was the structural study of the possible ways of interaction between drugs and viral cysteines by molecular docking technique for design of new potential inhibitors of MPRO and its virulence.Instituto Federal do Espírito Santo2020-06-13info:eu-repo/semantics/articleinfo:eu-repo/semantics/publishedVersionapplication/pdfhttps://ojs.ifes.edu.br/index.php/ric/article/view/74910.36524/ric.v6i1.749Revista Ifes Ciência ; v. 6 n. 1 (2020): Edição Especial COVID-19; 73-832359-479910.36524/ric.v6i1reponame:Revista Eletrônica Debates em Educação Científica e Tecnológicainstname:Instituto Federal de Educação, Ciência e Tecnologia do Espírito Santo (IFES)instacron:IFESporhttps://ojs.ifes.edu.br/index.php/ric/article/view/749/491Copyright (c) 2020 Revista Ifes Ciência info:eu-repo/semantics/openAccessGonçalves, Simone Queiroga Britoda Silva Filho, Eloi Alvesde Oliveira, Osmair Vital Gonçalves, Arlan da Silva2020-09-15T14:23:59Zoai::article/749Revistahttps://ojs.ifes.edu.br/index.php/indexPUBhttps://ojs.ifes.edu.br/index.php/index/oairevistadect@gmail.com||sidneiquezada@gmail.com2236-21502179-6955opendoar:2024-03-06T12:56:42.763193Revista Eletrônica Debates em Educação Científica e Tecnológica - Instituto Federal de Educação, Ciência e Tecnologia do Espírito Santo (IFES)false
dc.title.none.fl_str_mv CORONAVIRUS AND ITS MAIN PROTEASE: AN INSIGHT FOR DRUGS DESIGN BY MOLECULAR DOCKING
title CORONAVIRUS AND ITS MAIN PROTEASE: AN INSIGHT FOR DRUGS DESIGN BY MOLECULAR DOCKING
spellingShingle CORONAVIRUS AND ITS MAIN PROTEASE: AN INSIGHT FOR DRUGS DESIGN BY MOLECULAR DOCKING
Gonçalves, Simone Queiroga Brito
Coronavirus
Protease
Molecular docking
title_short CORONAVIRUS AND ITS MAIN PROTEASE: AN INSIGHT FOR DRUGS DESIGN BY MOLECULAR DOCKING
title_full CORONAVIRUS AND ITS MAIN PROTEASE: AN INSIGHT FOR DRUGS DESIGN BY MOLECULAR DOCKING
title_fullStr CORONAVIRUS AND ITS MAIN PROTEASE: AN INSIGHT FOR DRUGS DESIGN BY MOLECULAR DOCKING
title_full_unstemmed CORONAVIRUS AND ITS MAIN PROTEASE: AN INSIGHT FOR DRUGS DESIGN BY MOLECULAR DOCKING
title_sort CORONAVIRUS AND ITS MAIN PROTEASE: AN INSIGHT FOR DRUGS DESIGN BY MOLECULAR DOCKING
author Gonçalves, Simone Queiroga Brito
author_facet Gonçalves, Simone Queiroga Brito
da Silva Filho, Eloi Alves
de Oliveira, Osmair Vital
Gonçalves, Arlan da Silva
author_role author
author2 da Silva Filho, Eloi Alves
de Oliveira, Osmair Vital
Gonçalves, Arlan da Silva
author2_role author
author
author
dc.contributor.author.fl_str_mv Gonçalves, Simone Queiroga Brito
da Silva Filho, Eloi Alves
de Oliveira, Osmair Vital
Gonçalves, Arlan da Silva
dc.subject.por.fl_str_mv Coronavirus
Protease
Molecular docking
topic Coronavirus
Protease
Molecular docking
description Many viruses need their sulphydryl groups to be reduced in order to be allowed to enter cells. SARS-CoV-2, which belongs to Coronaviridae family and is responsible for coronavirus disease 2019 or COVID-19, has cysteine-rich proteins in its capsid as the main CoV protease (MPRO), which must be intact and active maintaining the viral activity. Considering that MPRO is an important molecular target for development of antiviral drugs, this work motivation was the structural study of the possible ways of interaction between drugs and viral cysteines by molecular docking technique for design of new potential inhibitors of MPRO and its virulence.
publishDate 2020
dc.date.none.fl_str_mv 2020-06-13
dc.type.driver.fl_str_mv info:eu-repo/semantics/article
info:eu-repo/semantics/publishedVersion
format article
status_str publishedVersion
dc.identifier.uri.fl_str_mv https://ojs.ifes.edu.br/index.php/ric/article/view/749
10.36524/ric.v6i1.749
url https://ojs.ifes.edu.br/index.php/ric/article/view/749
identifier_str_mv 10.36524/ric.v6i1.749
dc.language.iso.fl_str_mv por
language por
dc.relation.none.fl_str_mv https://ojs.ifes.edu.br/index.php/ric/article/view/749/491
dc.rights.driver.fl_str_mv Copyright (c) 2020 Revista Ifes Ciência
info:eu-repo/semantics/openAccess
rights_invalid_str_mv Copyright (c) 2020 Revista Ifes Ciência
eu_rights_str_mv openAccess
dc.format.none.fl_str_mv application/pdf
dc.publisher.none.fl_str_mv Instituto Federal do Espírito Santo
publisher.none.fl_str_mv Instituto Federal do Espírito Santo
dc.source.none.fl_str_mv Revista Ifes Ciência ; v. 6 n. 1 (2020): Edição Especial COVID-19; 73-83
2359-4799
10.36524/ric.v6i1
reponame:Revista Eletrônica Debates em Educação Científica e Tecnológica
instname:Instituto Federal de Educação, Ciência e Tecnologia do Espírito Santo (IFES)
instacron:IFES
instname_str Instituto Federal de Educação, Ciência e Tecnologia do Espírito Santo (IFES)
instacron_str IFES
institution IFES
reponame_str Revista Eletrônica Debates em Educação Científica e Tecnológica
collection Revista Eletrônica Debates em Educação Científica e Tecnológica
repository.name.fl_str_mv Revista Eletrônica Debates em Educação Científica e Tecnológica - Instituto Federal de Educação, Ciência e Tecnologia do Espírito Santo (IFES)
repository.mail.fl_str_mv revistadect@gmail.com||sidneiquezada@gmail.com
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