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l-Arginine Improves Solubility and ANTI SARS-CoV-2 Mpro Activity of Rutin but Not the Antiviral Activity in Cells
The COVID-19 pandemic outbreak prompts an urgent need for efficient therapeutics, and repurposing of known drugs has been extensively used in an attempt to get to anti-SARS-CoV-2 agents in the shortest possible time. The glycoside rutin shows manifold pharmacological activities and, despite its use...
Autores principales: | , , , , , , , , , , , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2021
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8512140/ https://www.ncbi.nlm.nih.gov/pubmed/34641606 http://dx.doi.org/10.3390/molecules26196062 |
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author | Sancineto, Luca Ostacolo, Carmine Ortega-Alarcon, David Jimenez-Alesanco, Ana Ceballos-Laita, Laura Vega, Sonia Abian, Olga Velazquez-Campoy, Adrian Moretti, Silvia Dabrowska, Agnieszka Botwina, Pawel Synowiec, Aleksandra Kula-Pacurar, Anna Pyrc, Krzysztof Iraci, Nunzio Santi, Claudio |
author_facet | Sancineto, Luca Ostacolo, Carmine Ortega-Alarcon, David Jimenez-Alesanco, Ana Ceballos-Laita, Laura Vega, Sonia Abian, Olga Velazquez-Campoy, Adrian Moretti, Silvia Dabrowska, Agnieszka Botwina, Pawel Synowiec, Aleksandra Kula-Pacurar, Anna Pyrc, Krzysztof Iraci, Nunzio Santi, Claudio |
author_sort | Sancineto, Luca |
collection | PubMed |
description | The COVID-19 pandemic outbreak prompts an urgent need for efficient therapeutics, and repurposing of known drugs has been extensively used in an attempt to get to anti-SARS-CoV-2 agents in the shortest possible time. The glycoside rutin shows manifold pharmacological activities and, despite its use being limited by its poor solubility in water, it is the active principle of many pharmaceutical preparations. We herein report our in silico and experimental investigations of rutin as a SARS-CoV-2 Mpro inhibitor and of its water solubility improvement obtained by mixing it with l-arginine. Tests of the rutin/l-arginine mixture in a cellular model of SARS-CoV-2 infection highlighted that the mixture still suffers from unfavorable pharmacokinetic properties, but nonetheless, the results of this study suggest that rutin might be a good starting point for hit optimization. |
format | Online Article Text |
id | pubmed-8512140 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2021 |
publisher | MDPI |
record_format | MEDLINE/PubMed |
spelling | pubmed-85121402021-10-14 l-Arginine Improves Solubility and ANTI SARS-CoV-2 Mpro Activity of Rutin but Not the Antiviral Activity in Cells Sancineto, Luca Ostacolo, Carmine Ortega-Alarcon, David Jimenez-Alesanco, Ana Ceballos-Laita, Laura Vega, Sonia Abian, Olga Velazquez-Campoy, Adrian Moretti, Silvia Dabrowska, Agnieszka Botwina, Pawel Synowiec, Aleksandra Kula-Pacurar, Anna Pyrc, Krzysztof Iraci, Nunzio Santi, Claudio Molecules Article The COVID-19 pandemic outbreak prompts an urgent need for efficient therapeutics, and repurposing of known drugs has been extensively used in an attempt to get to anti-SARS-CoV-2 agents in the shortest possible time. The glycoside rutin shows manifold pharmacological activities and, despite its use being limited by its poor solubility in water, it is the active principle of many pharmaceutical preparations. We herein report our in silico and experimental investigations of rutin as a SARS-CoV-2 Mpro inhibitor and of its water solubility improvement obtained by mixing it with l-arginine. Tests of the rutin/l-arginine mixture in a cellular model of SARS-CoV-2 infection highlighted that the mixture still suffers from unfavorable pharmacokinetic properties, but nonetheless, the results of this study suggest that rutin might be a good starting point for hit optimization. MDPI 2021-10-07 /pmc/articles/PMC8512140/ /pubmed/34641606 http://dx.doi.org/10.3390/molecules26196062 Text en © 2021 by the authors. https://creativecommons.org/licenses/by/4.0/Licensee MDPI, Basel, Switzerland. This article is an open access article distributed under the terms and conditions of the Creative Commons Attribution (CC BY) license (https://creativecommons.org/licenses/by/4.0/). |
spellingShingle | Article Sancineto, Luca Ostacolo, Carmine Ortega-Alarcon, David Jimenez-Alesanco, Ana Ceballos-Laita, Laura Vega, Sonia Abian, Olga Velazquez-Campoy, Adrian Moretti, Silvia Dabrowska, Agnieszka Botwina, Pawel Synowiec, Aleksandra Kula-Pacurar, Anna Pyrc, Krzysztof Iraci, Nunzio Santi, Claudio l-Arginine Improves Solubility and ANTI SARS-CoV-2 Mpro Activity of Rutin but Not the Antiviral Activity in Cells |
title | l-Arginine Improves Solubility and ANTI SARS-CoV-2 Mpro Activity of Rutin but Not the Antiviral Activity in Cells |
title_full | l-Arginine Improves Solubility and ANTI SARS-CoV-2 Mpro Activity of Rutin but Not the Antiviral Activity in Cells |
title_fullStr | l-Arginine Improves Solubility and ANTI SARS-CoV-2 Mpro Activity of Rutin but Not the Antiviral Activity in Cells |
title_full_unstemmed | l-Arginine Improves Solubility and ANTI SARS-CoV-2 Mpro Activity of Rutin but Not the Antiviral Activity in Cells |
title_short | l-Arginine Improves Solubility and ANTI SARS-CoV-2 Mpro Activity of Rutin but Not the Antiviral Activity in Cells |
title_sort | l-arginine improves solubility and anti sars-cov-2 mpro activity of rutin but not the antiviral activity in cells |
topic | Article |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8512140/ https://www.ncbi.nlm.nih.gov/pubmed/34641606 http://dx.doi.org/10.3390/molecules26196062 |
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