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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...

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Autores principales: Gogoi, Dhrubajyoti, Bezbaruah, Rajib Lochan, Bordoloi, Manabjyoti, Sarmah, Rajeev, Bora, Tarun Chandra
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Biomedical Informatics 2012
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.
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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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