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Combined in silico and in vitro approaches identified the antipsychotic drug lurasidone and the antiviral drug elbasvir as SARS-CoV2 and HCoV-OC43 inhibitors

The current emergency of the novel coronavirus SARS-CoV2 urged the need for broad-spectrum antiviral drugs as the first line of treatment. Coronaviruses are a large family of viruses that already challenged humanity in at least two other previous outbreaks and are likely to be a constant threat for...

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Autores principales: Milani, Mario, Donalisio, Manuela, Bonotto, Rafaela Milan, Schneider, Edoardo, Arduino, Irene, Boni, Francesco, Lembo, David, Marcello, Alessandro, Mastrangelo, Eloise
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Author(s). Published by Elsevier B.V. 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7944860/
https://www.ncbi.nlm.nih.gov/pubmed/33713730
http://dx.doi.org/10.1016/j.antiviral.2021.105055
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author Milani, Mario
Donalisio, Manuela
Bonotto, Rafaela Milan
Schneider, Edoardo
Arduino, Irene
Boni, Francesco
Lembo, David
Marcello, Alessandro
Mastrangelo, Eloise
author_facet Milani, Mario
Donalisio, Manuela
Bonotto, Rafaela Milan
Schneider, Edoardo
Arduino, Irene
Boni, Francesco
Lembo, David
Marcello, Alessandro
Mastrangelo, Eloise
author_sort Milani, Mario
collection PubMed
description The current emergency of the novel coronavirus SARS-CoV2 urged the need for broad-spectrum antiviral drugs as the first line of treatment. Coronaviruses are a large family of viruses that already challenged humanity in at least two other previous outbreaks and are likely to be a constant threat for the future. In this work we developed a pipeline based on in silico docking of known drugs on SARS-CoV1/2 RNA-dependent RNA polymerase combined with in vitro antiviral assays on both SARS-CoV2 and the common cold human coronavirus HCoV-OC43. Results showed that certain drugs displayed activity for both viruses at a similar inhibitory concentration, while others were specific. In particular, the antipsychotic drug lurasidone and the antiviral drug elbasvir showed promising activity in the low micromolar range against both viruses with good selectivity index.
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spelling pubmed-79448602021-03-11 Combined in silico and in vitro approaches identified the antipsychotic drug lurasidone and the antiviral drug elbasvir as SARS-CoV2 and HCoV-OC43 inhibitors Milani, Mario Donalisio, Manuela Bonotto, Rafaela Milan Schneider, Edoardo Arduino, Irene Boni, Francesco Lembo, David Marcello, Alessandro Mastrangelo, Eloise Antiviral Res Research Paper The current emergency of the novel coronavirus SARS-CoV2 urged the need for broad-spectrum antiviral drugs as the first line of treatment. Coronaviruses are a large family of viruses that already challenged humanity in at least two other previous outbreaks and are likely to be a constant threat for the future. In this work we developed a pipeline based on in silico docking of known drugs on SARS-CoV1/2 RNA-dependent RNA polymerase combined with in vitro antiviral assays on both SARS-CoV2 and the common cold human coronavirus HCoV-OC43. Results showed that certain drugs displayed activity for both viruses at a similar inhibitory concentration, while others were specific. In particular, the antipsychotic drug lurasidone and the antiviral drug elbasvir showed promising activity in the low micromolar range against both viruses with good selectivity index. The Author(s). Published by Elsevier B.V. 2021-05 2021-03-10 /pmc/articles/PMC7944860/ /pubmed/33713730 http://dx.doi.org/10.1016/j.antiviral.2021.105055 Text en © 2021 The Author(s) Since January 2020 Elsevier has created a COVID-19 resource centre with free information in English and Mandarin on the novel coronavirus COVID-19. The COVID-19 resource centre is hosted on Elsevier Connect, the company's public news and information website. Elsevier hereby grants permission to make all its COVID-19-related research that is available on the COVID-19 resource centre - including this research content - immediately available in PubMed Central and other publicly funded repositories, such as the WHO COVID database with rights for unrestricted research re-use and analyses in any form or by any means with acknowledgement of the original source. These permissions are granted for free by Elsevier for as long as the COVID-19 resource centre remains active.
spellingShingle Research Paper
Milani, Mario
Donalisio, Manuela
Bonotto, Rafaela Milan
Schneider, Edoardo
Arduino, Irene
Boni, Francesco
Lembo, David
Marcello, Alessandro
Mastrangelo, Eloise
Combined in silico and in vitro approaches identified the antipsychotic drug lurasidone and the antiviral drug elbasvir as SARS-CoV2 and HCoV-OC43 inhibitors
title Combined in silico and in vitro approaches identified the antipsychotic drug lurasidone and the antiviral drug elbasvir as SARS-CoV2 and HCoV-OC43 inhibitors
title_full Combined in silico and in vitro approaches identified the antipsychotic drug lurasidone and the antiviral drug elbasvir as SARS-CoV2 and HCoV-OC43 inhibitors
title_fullStr Combined in silico and in vitro approaches identified the antipsychotic drug lurasidone and the antiviral drug elbasvir as SARS-CoV2 and HCoV-OC43 inhibitors
title_full_unstemmed Combined in silico and in vitro approaches identified the antipsychotic drug lurasidone and the antiviral drug elbasvir as SARS-CoV2 and HCoV-OC43 inhibitors
title_short Combined in silico and in vitro approaches identified the antipsychotic drug lurasidone and the antiviral drug elbasvir as SARS-CoV2 and HCoV-OC43 inhibitors
title_sort combined in silico and in vitro approaches identified the antipsychotic drug lurasidone and the antiviral drug elbasvir as sars-cov2 and hcov-oc43 inhibitors
topic Research Paper
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7944860/
https://www.ncbi.nlm.nih.gov/pubmed/33713730
http://dx.doi.org/10.1016/j.antiviral.2021.105055
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