The quantitative structure–insecticidal activity relationships from plant derived compounds against chikungunya and zika Aedes aegypti (Diptera:Culicidae) vector

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dc.contributor.authorSaavedra, Laura M.
dc.contributor.authorRomanelli, Gustavo P.
dc.contributor.authorRozo, Ciro E.
dc.contributor.authorDuchowicz, Pablo R.
dc.date.accessioned2019-08-08T18:07:37Z
dc.date.available2019-08-08T18:07:37Z
dc.date.issued2018-01-01
dc.description.abstractThe insecticidal activity of a series of 62 plant derivedmolecules against the chikungunya, dengue and zika vector, the Aedes aegypti (Diptera:Culicidae) mosquito, is subjected to a Quantitative Structure–Activity Relationships (QSAR) analysis. The Replacement Method (RM) variable subset selection technique based on Multivariable Linear Regression (MLR) proves to be successful for exploring 4885 molecular descriptors calculatedwith Dragon 6. The predictive capability of the obtained models is confirmed through an external test set of compounds, Leave- One-Out (LOO) cross-validation and Y-Randomization. The present study constitutes a first necessary computational step for designing less toxic insecticides.spa
dc.description.domainhttp://unidadinvestigacion.usta.edu.cospa
dc.format.mimetypeapplication/pdf
dc.identifier.doihttps://doi.org/10.1016/j.scitotenv.2017.08.119spa
dc.identifier.urihttp://hdl.handle.net/11634/18028
dc.publisher.branchCRAI-USTA Bogotáspa
dc.relation.referencesBarbosa, J.D.F., Silva, V.B., Alves, P.B., Gumina, G., Santos, R.L.C., Sousa, D.P., Cavalcantia, S.C.H., 2012. Structure–activity relationships of eugenol derivatives against Aedes aegypti (Diptera: Culicidae) larvae. Pest Manag. Sci. 68, 1478–1483.spa
dc.relation.referencesBhattacharjee, A.K., Dheranetra, W., Nichols, D.A., Gupta, R.K., 2005. 3D pharmacophore model for insect repellent activity and discovery of new repellent candidates. QSAR Comb. Sci. 24, 593–602.spa
dc.relation.referencesCarrasco, H., Raimondi, M., Svetaz, L., Di Liberto, M., Rodriguez, M.V., Espinoza, L., Madrid, A., Zacchino, S., 2012. Antifungal activity of eugenol analogues. Influence of different substituents and studies on mechanism of action. Molecules 17, 1002–1024.spa
dc.relation.referencesCeferina, A., Zygadlo, J., Mougabure, G., Biurrun, F., Zerba, E., Picollo, M., 2006. Fumigant and repellent properties of essential oils and component compounds againts permethrin-resistant Pediculus humanus capitis (anoplura: pediculidae) from Argentina. J. Med. Entomol. 43, 889–895.spa
dc.relation.referencesDuchowicz, P.R., Castro, E.A., Fernández, F.M., González, M.P., 2005. A new search algorithm of QSPR/QSAR theories: normal boiling points of some organic molecules. Chem. Phys. Lett. 412, 376–380.spa
dc.relation.referencesEnvironment Protection Agency- EPA; U. E. P. A N,N-Diethyl-m-toluamide (DEET). 1980, 1, 12–32.spa
dc.relation.referencesGillij, Y. G.; Gleiser, R. M.; Zygadlo, J. A., Mosquito repellent activity of essential oils of aromatic plants growing in Argentina. Bioresour. Technol. 2008, 99. 2507–2515.spa
dc.relation.referencesHansch, C., Leo, A., 1995. Exploring QSAR. Fundamentals and Applications in Chemistry and Biology. American Chemical Society, Washington, D. C.spa
dc.relation.referencesIbezim, E., Duchowicz, P.R., Ortiz, E.V., Castro, E.A., 2012. QSAR on aryl-piperazine derivatives with activity on malaria. Chemom. Intell. Lab. Syst. 110, 81–88.spa
dc.relation.referencesKatritzky, A.R., Lobanov, V.S., Karelson, M., 1995. QSPR: the correlation and quantitative prediction of chemical and physical properties from structure. Chem. Soc. Rev. 24, 279–287.spa
dc.relation.referencesMatlab 7.0. Masachussetts, USA: The MathWorks. Inc. URL (http:// www.mathworks.com).spa
dc.relation.referencesNational Pesticide Information Center- NPIC; Oregon State University, 1999n. DDT (Technical Fact Sheet). URL. http://npic.orst.edu/factsheets/ddttech.pdf Consulting date 20 of March 2015.spa
dc.relation.referencesOcampoa, C.B., Salazar-Terrerosa, M.J., Minaa, N.J., McAllisterb, J., Brogdonc, W., 2011. Insecticide resistance status of Aedes aegypti in 10 localities in Colombia. Acta Trop. 118, 37–44.spa
dc.relation.referencesPutz, M.V., Dudas, N.A., 2013. Variational principles for mechanistic quantitative structure–activity relationship (QSAR) studies: application on uracil derivatives' anti-HIV action. Struct. Chem. 24, 1873–1893.spa
dc.relation.referencesRice, P., Coats, J., 1994. Insecticidal properties of monoterpenoid derivatives to the house fly (Diptera: Muscidae) and red flour beetle (Coleoptera: Tenebrionidae). Pestic. Sci. 41, 195–202.spa
dc.relation.referencesSantos, S.R.L., Silva, V.S., Melo, M.A., Barbosa, J.D.F., Santos, R.L.C., Sousa, D.P., Cavalcanti, S.C.H., 2010. Toxic effects on and structure-toxicity relationships of phenylpropanoids, terpenes and related compounds in Aedes aegypti larvae. Vector- Borne Zoonotic Dis. 10, 1049–1054.spa
dc.relation.referencesTalete srl, d. Dragon (Software for Molecular Descriptor Calculation) Version 6.0–2014. URL. http://www.talete.mi.it.spa
dc.relation.referencesWHO, 2006. Pesticides and their application for the control of vectors and pests of public health importance. 6th ed. World Health Organization, Department of Control of Neglected Tropical Diseases, Pesticides Evaluation Scheme, Geneva URL. http:// whqlibdoc.who.int/hq/2006/WHO_CDS_NTD_WHOPES_GCDPP_2006.1_eng.pdf (Consulting date 5 of February 2017).spa
dc.relation.referencesXiao, Y., Yu, J., 2012. Partitive clustering (K-means family). WIREs Data Mining Knowl Discov. 2, 209–225.spa
dc.relation.referencesZhou, L.; Wang, J.; Wang, K.; Xu, J.; Zhao, J.; Shan, T.; Luo, C., Secondary Metabolites with Antinematodal Activity from Higher Plants. Studies in Natural Products Chemistry. Bioactive Natural Products. Atta-ur-Rahman F.R.S., Eds.; Elsevier Press: Oxford. 2012, p. 67–114.spa
dc.rightsAtribución-NoComercial-CompartirIgual 2.5 Colombia
dc.rights.urihttp://creativecommons.org/licenses/by-nc-sa/2.5/co/
dc.subject.keywordInsecticidal activityspa
dc.subject.keywordChikungunyaspa
dc.subject.keywordZikaspa
dc.subject.keywordAedes aegyptispa
dc.subject.keywordQSAR theoryspa
dc.subject.keywordMLR analysisspa
dc.titleThe quantitative structure–insecticidal activity relationships from plant derived compounds against chikungunya and zika Aedes aegypti (Diptera:Culicidae) vectorspa
dc.type.categoryGeneración de Nuevo Conocimiento: Artículos publicados en revistas especializadas - Electrónicosspa

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