Synthesis, biological evaluation and molecular modeling of a novel series of fused 1,2,3-triazoles as potential anti-coronavirus agents
Synthesis and biological evaluation of a novel library of fused 1,2,3-triazole derivatives are described. The in-house developed multicomponent reaction based on commercially available starting materials was applied and broad biological screening against various viruses was performed, showing promis...
| Autores principales: | , , , , , , , |
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| Formato: | article |
| Lenguaje: | Español |
| Publicado: |
2021
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| Materias: | |
| Acceso en línea: | https://doi.org/10.1016/j.bmcl.2018.09.019 http://hdl.handle.net/11086/19824 https://www.sciencedirect.com/science/article/abs/pii/S0960894X18307509?via%3Dihub |
| Aporte de: |
| id |
I10-R14111086-19824 |
|---|---|
| record_format |
dspace |
| institution |
Universidad Nacional de Córdoba |
| institution_str |
I-10 |
| repository_str |
R-141 |
| collection |
Repositorio Digital Universitario (UNC) |
| language |
Español |
| topic |
Covid 19 Coronavirus Respiratory syndrome Coronavirus 3CL protease 1,2,3-triazole Biological evaluation |
| spellingShingle |
Covid 19 Coronavirus Respiratory syndrome Coronavirus 3CL protease 1,2,3-triazole Biological evaluation Karypidou, Konstantina Ribone, Sergio Roman Quevedo, Mario Alfredo Persoons, Leentje Pannecouque, Christophe Helsen, Christine Claessens, Frank Dehaen, Wim Synthesis, biological evaluation and molecular modeling of a novel series of fused 1,2,3-triazoles as potential anti-coronavirus agents |
| topic_facet |
Covid 19 Coronavirus Respiratory syndrome Coronavirus 3CL protease 1,2,3-triazole Biological evaluation |
| description |
Synthesis and biological evaluation of a novel library of fused 1,2,3-triazole derivatives are described. The in-house developed multicomponent reaction based on commercially available starting materials was applied and broad biological screening against various viruses was performed, showing promising antiviral properties for compounds 14d, 14n, 14q, 18f and 18i against human coronavirus 229E. Further in silico studies identified the key molecular interactions between those compounds and the 3-chymotrypsin-like protease, which is essential to the intracellular replication of the virus, supporting the hypothesis that the protease is the target molecule of the potential antiviral derivatives. |
| format |
article |
| author |
Karypidou, Konstantina Ribone, Sergio Roman Quevedo, Mario Alfredo Persoons, Leentje Pannecouque, Christophe Helsen, Christine Claessens, Frank Dehaen, Wim |
| author_facet |
Karypidou, Konstantina Ribone, Sergio Roman Quevedo, Mario Alfredo Persoons, Leentje Pannecouque, Christophe Helsen, Christine Claessens, Frank Dehaen, Wim |
| author_sort |
Karypidou, Konstantina |
| title |
Synthesis, biological evaluation and molecular modeling of a novel series of fused 1,2,3-triazoles as potential anti-coronavirus agents |
| title_short |
Synthesis, biological evaluation and molecular modeling of a novel series of fused 1,2,3-triazoles as potential anti-coronavirus agents |
| title_full |
Synthesis, biological evaluation and molecular modeling of a novel series of fused 1,2,3-triazoles as potential anti-coronavirus agents |
| title_fullStr |
Synthesis, biological evaluation and molecular modeling of a novel series of fused 1,2,3-triazoles as potential anti-coronavirus agents |
| title_full_unstemmed |
Synthesis, biological evaluation and molecular modeling of a novel series of fused 1,2,3-triazoles as potential anti-coronavirus agents |
| title_sort |
synthesis, biological evaluation and molecular modeling of a novel series of fused 1,2,3-triazoles as potential anti-coronavirus agents |
| publishDate |
2021 |
| url |
https://doi.org/10.1016/j.bmcl.2018.09.019 http://hdl.handle.net/11086/19824 https://www.sciencedirect.com/science/article/abs/pii/S0960894X18307509?via%3Dihub |
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