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Pharmacophore Modelling and Synthesis of Quinoline-3-Carbohydrazide as Antioxidants
From well-known antioxidants agents, we developed a first pharmacophore model containing four common chemical features: one aromatic ring and three hydrogen bond acceptors. This model served as a template in virtual screening of Maybridge and NCI databases that resulted in selection of sixteen compo...
Autores principales: | , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Hindawi Publishing Corporation
2011
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4412044/ https://www.ncbi.nlm.nih.gov/pubmed/25954520 http://dx.doi.org/10.1155/2011/592879 |
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author | El Bakkali, Mustapha Ismaili, Lhassane Tomassoli, Isabelle Nicod, Laurence Pudlo, Marc Refouvelet, Bernard |
author_facet | El Bakkali, Mustapha Ismaili, Lhassane Tomassoli, Isabelle Nicod, Laurence Pudlo, Marc Refouvelet, Bernard |
author_sort | El Bakkali, Mustapha |
collection | PubMed |
description | From well-known antioxidants agents, we developed a first pharmacophore model containing four common chemical features: one aromatic ring and three hydrogen bond acceptors. This model served as a template in virtual screening of Maybridge and NCI databases that resulted in selection of sixteen compounds. The selected compounds showed a good antioxidant activity measured by three chemical tests: DPPH radical, OH° radical, and superoxide radical scavenging. New synthetic compounds with a good correlation with the model were prepared, and some of them presented a good antioxidant activity. |
format | Online Article Text |
id | pubmed-4412044 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2011 |
publisher | Hindawi Publishing Corporation |
record_format | MEDLINE/PubMed |
spelling | pubmed-44120442015-05-07 Pharmacophore Modelling and Synthesis of Quinoline-3-Carbohydrazide as Antioxidants El Bakkali, Mustapha Ismaili, Lhassane Tomassoli, Isabelle Nicod, Laurence Pudlo, Marc Refouvelet, Bernard Int J Med Chem Research Article From well-known antioxidants agents, we developed a first pharmacophore model containing four common chemical features: one aromatic ring and three hydrogen bond acceptors. This model served as a template in virtual screening of Maybridge and NCI databases that resulted in selection of sixteen compounds. The selected compounds showed a good antioxidant activity measured by three chemical tests: DPPH radical, OH° radical, and superoxide radical scavenging. New synthetic compounds with a good correlation with the model were prepared, and some of them presented a good antioxidant activity. Hindawi Publishing Corporation 2011 2011-02-14 /pmc/articles/PMC4412044/ /pubmed/25954520 http://dx.doi.org/10.1155/2011/592879 Text en Copyright © 2011 Mustapha El Bakkali et al. https://creativecommons.org/licenses/by/3.0/ This is an open access article distributed under the Creative Commons Attribution License, which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly cited. |
spellingShingle | Research Article El Bakkali, Mustapha Ismaili, Lhassane Tomassoli, Isabelle Nicod, Laurence Pudlo, Marc Refouvelet, Bernard Pharmacophore Modelling and Synthesis of Quinoline-3-Carbohydrazide as Antioxidants |
title |
Pharmacophore Modelling and Synthesis of Quinoline-3-Carbohydrazide as Antioxidants |
title_full |
Pharmacophore Modelling and Synthesis of Quinoline-3-Carbohydrazide as Antioxidants |
title_fullStr |
Pharmacophore Modelling and Synthesis of Quinoline-3-Carbohydrazide as Antioxidants |
title_full_unstemmed |
Pharmacophore Modelling and Synthesis of Quinoline-3-Carbohydrazide as Antioxidants |
title_short |
Pharmacophore Modelling and Synthesis of Quinoline-3-Carbohydrazide as Antioxidants |
title_sort | pharmacophore modelling and synthesis of quinoline-3-carbohydrazide as antioxidants |
topic | Research Article |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4412044/ https://www.ncbi.nlm.nih.gov/pubmed/25954520 http://dx.doi.org/10.1155/2011/592879 |
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