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Development of chromatographic / electrophoretic methods to be further applied in in vitro enzymatic inhibition studies and prediction of drug interactions of chiral pesticides - Phase 2

Abstract

Quantification of analytes present in biological matrices requires the development of methods that are accurate and reproducible under various analytical conditions. Chromatographic and electrophoretic techniques (capillary electrophoresis) are techniques widely used for these purposes. These techniques have the main advantage of simplicity, rapid analysis and wide versatility. Our research group has been working on the development and validation of chromatographic and electrophoretic methods to be further applied in studies of in vitro metabolism and biotransformation involving chiral drugs as well as natural products. In this new proposal, we have the objectives of continuing the previously initiated project (FAPESP 2016/07597-0), which expires on 07/30/2018. In this new project we will evaluate the chiral pesticides tebocunazol, ethofumesate and diclofop-methyl. The main objective is the determination of enantioselectivity in the in vitro metabolism of these chiral pesticides and subsequent in vitro studies of enzymatic inhibition, phenotyping and prediction of drug interactions. These studies will be conducted with the racemic mixture and with the isolated enantiomers and the results of both studies will be compared. Our motivation for the continuity of this project lies in the fact that our studies with fenamiphos, myclobutanil and fipronil pesticides in project 2016/07597-0 have shown a great potential for inhibition, by these pesticides, on cytochrome P450 enzymes. In addition, there are several enantioselective studies that evaluate the toxicity, ecotoxicity and environmental impact of pesticide enantiomers, and although humans are in contact with these toxicants (either during work or through food intake) enzyme inhibition studies and prediction of drug interactions for the evaluation of risks exposure to these products have been performed very little using human models. In this context, analytical methods will be developed and validated for this purpose. (AU)

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Scientific publications (13)
(References retrieved automatically from Web of Science and SciELO through information on FAPESP grants and their corresponding numbers as mentioned in the publications by the authors)
ROCHA, BRUNO ALVES; DE OLIVEIRA, SILVANA RUELLA; DA SILVA, RODRIGO MOREIRA; MAZZARON BARCELOS, GUSTAVO RAFAEL; MORAES DE OLIVEIRA, ANDERSON RODRIGO; BARBOSA JR, FERNANDO. An eco-friendly sample preparation procedure base on low-density solvent-based air-assisted liquid-liquid microextraction for the simultaneous determination of 21 potential endocrine disruptors in urine samples by liquid chromatography-tandem mass spectrometry. Microchemical Journal, v. 147, p. 207-214, . (14/19914-5, 14/50945-4, 18/07534-4, 14/50867-3)
PEROVANI, ICARO SALGADO; MORAES DE OLIVEIRA, ANDERSON RODRIGO. Determination of Ethofumesate-2-hydroxy Stereolability by Dynamic HPLC. SEPARATION SCIENCE PLUS, v. 1, n. 12, p. 771-775, . (14/50945-4, 18/07534-4)
HABENSCHUS, MAISA DANIELA; NARDINI, VIVIANI; DIAS, LUIS GUSTAVO; ROCHA, BRUNO ALVES; BARBOSA, JR., FERNANDO; MORAES DE OLIVEIRA, ANDERSON RODRIGO. In vitro enantioselective study of the toxicokinetic effects of chiral fungicide tebuconazole in human liver microsomes. ECOTOXICOLOGY AND ENVIRONMENTAL SAFETY, v. 181, p. 96-105, . (14/50945-4, 13/08166-5, 18/07534-4, 17/03204-7)
CARRAO, DANIEL BLASCKE; PEROVANI, ICARO SALGADO; PEREZ DE ALBUQUERQUE, NAYARA CRISTINA; MORAES DE OLIVEIRA, ANDERSON RODRIGO. Enantioseparation of pesticides: A critical review. TRAC-TRENDS IN ANALYTICAL CHEMISTRY, v. 122, . (14/50945-4, 16/15680-5, 18/14668-7, 18/07534-4)
PEROVANI, ICARO SALGADO; MORAES DE OLIVEIRA, ANDERSON RODRIGO. Enantioselective in vitro metabolism and in vitro-in vivo correlation of the herbicide ethofumesate in a human model. Journal of Pharmaceutical and Biomedical Analysis, v. 187, . (14/50945-4, 18/07534-4)
DA SILVA, RODRIGO MOREIRA; CARRAO, DANIEL BLASCKE; HABENSCHUS, MAISA DANIELA; JIMENEZ, PAULA CHRISTINE; LOPS, NORBERTO PEPORINE; FENICAL, WILLIAM; COSTA-LOTUFO, LETICIA VERA; MORAES DE OLIVEIRA, ANDERSON RODRIGO. Prediction of seriniquinone-drug interactions by in vitro inhibition of human cytochrome P450 enzymes. TOXICOLOGY IN VITRO, v. 65, . (14/50265-3, 14/50945-4, 16/15680-5, 16/06366-5, 18/07534-4)
MARTINS, JULIA; COELHO, JOANA; TADINI, MARAINE CATARINA; DE SOUZA, REBECA OLIVEIRA; FIGUEIREDO, SONIA APARECIDA; VIEIRA FONSECA, MARIA JOSE; PEREZ DE ALBUQUERQUE, NAYARA CRISTINA; LOPES, NORBERTO PEPORINE; BERRETTA, ANDRESA; MARQUELE-OLIVEIRA, FRANCIANE; et al. Yangambin and Epi-yangambin Isomers: New Purification Method from Ocotea fasciculata and First Cytotoxic Aspects Focusing on In Vivo Safety. Planta Medica, v. 86, n. 6, p. 415-424, . (16/07597-0, 18/07534-4)
CARRAO, DANIEL BLASCKE; DOS REIS GOMES, ISABEL CRISTINA; BARBOSA JUNIOR, FERNANDO; MORAES DE OLIVEIRA, ANDERSON RODRIGO. Evaluation of the enantioselective in vitro metabolism of the chiral pesticide fipronil employing a human model: Risk assessment through in vitro-in vivo correlation and prediction of toxicokinetic parameters. Food and Chemical Toxicology, v. 123, p. 225-232, . (16/15680-5, 18/07534-4, 16/07597-0, 14/50945-4)
FONSECA, FRANCIELE S.; CARRAO, DANIEL B.; DE ALBUQUERQUE, NAYARA C. P.; NARDINI, VIVIANI; DIAS, LUIS G.; DA SILVA, RODRIGO M.; LOPES, NORBERTO P.; DE OLIVEIRA, ANDERSON R. M.. Myclobutanil enantioselective risk assessment in humans through in vitro CYP450 reactions: Metabolism and inhibition studies. Food and Chemical Toxicology, v. 128, p. 202-211, . (16/07597-0, 13/08166-5, 14/50945-4, 18/07534-4, 17/03204-7)
CARRAO, DANIEL BLASCKE; HABENCHUS, MAISA DANIELA; PEREZ DE ALBUQUERQUE, NAYARA CRISTINA; DA SILVA, RODRIGO MOREIRA; LOPES, NORBERTO PEPORINE; MORAES DE OLIVEIRA, ANDERSON RODRIGO. In vitro inhibition of human CYP2D6 by the chiral pesticide fipronil and its metabolite fipronil sulfone: Prediction of pesticide-drug interactions. Toxicology Letters, v. 313, p. 196-204, . (16/07597-0, 14/50945-4, 16/15680-5, 18/14668-7, 18/07534-4)
PEROVANI, ICARO SALGADO; SERPELLONE, CAROLINA OLIVEIRA; DE OLIVEIRA, ANDERSON RODRIGO MORAES. An appraisal of experimental designs: Application to enantioselective capillary electromigration techniques. ELECTROPHORESIS, v. 42, n. 17-18, SI, p. 1726-1743, . (14/50945-4, 18/07534-4, 20/02139-0)
HABENSCHUS, MAISA DANIELA; CARRAO, DANIEL BLASCKE; PEREZ DE ALBUQUERQUE, NAYARA CRISTINA; PEROVANI, ICARO SALGADO; DA SILVA, RODRIGO MOREIRA; NARDINI, VIVIANI; LOPES, NORBERTO PEPORINE; DIAS, LUIS GUSTAVO; MORAES DE OLIVEIRA, ANDERSON RODRIGO. In vitro enantioselective inhibition of the main human CYP450 enzymes involved in drug metabolism by the chiral pesticide tebuconazole. Toxicology Letters, v. 351, p. 1-9, . (14/50945-4, 18/07534-4, 17/03204-7)
PEROVANI, ICARO SALGADO; MARIANO BUCCI, JADE LORENA; CARRAO, DANIEL BLASCKE; SANTOS BARBETTA, MAIKE FELIPE; DA SILVA, RODRIGO MOREIRA; LOPES, NORBERTO PEPORINE; MORAES DE OLIVEIRA, ANDERSON RODRIGO. Enantioselective inhibition of human CYP2C19 by the chiral pesticide ethofumesate: Prediction of pesticide-drug interactions in humans. Chemico-Biological Interactions, v. 345, . (14/50945-4, 18/07534-4, 19/12149-5, 20/02139-0)

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