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Insights from the docking analysis of biologically active compounds from plant Litsea Genus as potential COX-2 inhibitors
Litsea spp of Laural family are traditionally used as herbal medicine for treating inflammation including gastroenterologia, oedema and rheumatic arthritis. Therefore, it is of interest to investigate and understand the molecular principles for such actions. Here, we have illustrated the binding of...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Biomedical Informatics
2012
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3488843/ https://www.ncbi.nlm.nih.gov/pubmed/23139590 http://dx.doi.org/10.6026/97320630008812 |
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author | Gogoi, Dhrubajyoti Bezbaruah, Rajib Lochan Bordoloi, Manabjyoti Sarmah, Rajeev Bora, Tarun Chandra |
author_facet | Gogoi, Dhrubajyoti Bezbaruah, Rajib Lochan Bordoloi, Manabjyoti Sarmah, Rajeev Bora, Tarun Chandra |
author_sort | Gogoi, Dhrubajyoti |
collection | PubMed |
description | Litsea spp of Laural family are traditionally used as herbal medicine for treating inflammation including gastroenterologia, oedema and rheumatic arthritis. Therefore, it is of interest to investigate and understand the molecular principles for such actions. Here, we have illustrated the binding of thirteen Litsea derived biologically active compounds against the inflammation associated target COX (cyclo-oxygenase) -2 enzymes. We compared the binding information of these compounds with a selected number of already known COX-2 inhibitors. The comparison reflected that some of these compounds such as linderol, catechin, 6'-hydroxy-2',3',4' - trimethoxy-chalcone and litseaone have better or equivalent binding features compared to already known inhibitory compounds namely celecoxib, acetylsalicylic acid, rofecoxib. Therefore, all these small compounds reported from plant Litsea spp were found to possess potential medicinal values with anti-inflammatory properties. |
format | Online Article Text |
id | pubmed-3488843 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | Biomedical Informatics |
record_format | MEDLINE/PubMed |
spelling | pubmed-34888432012-11-08 Insights from the docking analysis of biologically active compounds from plant Litsea Genus as potential COX-2 inhibitors Gogoi, Dhrubajyoti Bezbaruah, Rajib Lochan Bordoloi, Manabjyoti Sarmah, Rajeev Bora, Tarun Chandra Bioinformation Hypothesis Litsea spp of Laural family are traditionally used as herbal medicine for treating inflammation including gastroenterologia, oedema and rheumatic arthritis. Therefore, it is of interest to investigate and understand the molecular principles for such actions. Here, we have illustrated the binding of thirteen Litsea derived biologically active compounds against the inflammation associated target COX (cyclo-oxygenase) -2 enzymes. We compared the binding information of these compounds with a selected number of already known COX-2 inhibitors. The comparison reflected that some of these compounds such as linderol, catechin, 6'-hydroxy-2',3',4' - trimethoxy-chalcone and litseaone have better or equivalent binding features compared to already known inhibitory compounds namely celecoxib, acetylsalicylic acid, rofecoxib. Therefore, all these small compounds reported from plant Litsea spp were found to possess potential medicinal values with anti-inflammatory properties. Biomedical Informatics 2012-09-11 /pmc/articles/PMC3488843/ /pubmed/23139590 http://dx.doi.org/10.6026/97320630008812 Text en © 2012 Biomedical Informatics This is an open-access article, which permits unrestricted use, distribution, and reproduction in any medium, for non-commercial purposes, provided the original author and source are credited. |
spellingShingle | Hypothesis Gogoi, Dhrubajyoti Bezbaruah, Rajib Lochan Bordoloi, Manabjyoti Sarmah, Rajeev Bora, Tarun Chandra Insights from the docking analysis of biologically active compounds from plant Litsea Genus as potential COX-2 inhibitors |
title | Insights from the docking analysis of biologically active compounds from plant Litsea Genus as potential COX-2 inhibitors |
title_full | Insights from the docking analysis of biologically active compounds from plant Litsea Genus as potential COX-2 inhibitors |
title_fullStr | Insights from the docking analysis of biologically active compounds from plant Litsea Genus as potential COX-2 inhibitors |
title_full_unstemmed | Insights from the docking analysis of biologically active compounds from plant Litsea Genus as potential COX-2 inhibitors |
title_short | Insights from the docking analysis of biologically active compounds from plant Litsea Genus as potential COX-2 inhibitors |
title_sort | insights from the docking analysis of biologically active compounds from plant litsea genus as potential cox-2 inhibitors |
topic | Hypothesis |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3488843/ https://www.ncbi.nlm.nih.gov/pubmed/23139590 http://dx.doi.org/10.6026/97320630008812 |
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