Schinus terebinthifolius Raddi: a literature review associated with an in silico study
Autor(a) principal: | |
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Data de Publicação: | 2022 |
Outros Autores: | , , |
Tipo de documento: | Artigo |
Idioma: | por |
Título da fonte: | Research, Society and Development |
Texto Completo: | https://rsdjournal.org/index.php/rsd/article/view/34262 |
Resumo: | The present work gathered studies in the literature about the biological activities of Schinus terebinthifolius and evaluated possible physicochemical, pharmacokinetic, and toxicity characteristics of molecules isolated from this species. Initially, a broad literature review was conducted using the following databases: Google Scholar, Portal de Periódicos Capes, SciELO and PubMed, with the descriptors: "Schinus terebinthifolius Raddi", "pharmacological properties", "isolated compounds", including studies published in Portuguese and English between the years 2001 and The selected molecules were designed in MarvinSketch software and submitted to PreADMET and Protox II software. Regarding the biological studies, the literature revealed that S. terebinthifolius has the activities: anti-inflammatory, wound healing, anti-ulcer, antibacterial, antifungal, antioxidant, antihistaminic, larvicidal, insecticidal, and repellent. The chemical studies showed that S. terebinthifolius has a significant amount of terpenes, especially monoterpenes and sesquiterpenes. The following molecules were selected: limonene, α-pinene, β-pinene, α-felandrene, δ-3-carene, germacrene D, myrcene, and o-cymene. The literature concerning S. terebinthifolius demonstrates how this plant has an extensive framework of activities. It was observed that the molecules presented advantages and disadvantages in physicochemical, pharmacokinetic and toxicological parameters. In general, all molecules followed Lipinski's rule, and all molecules were toxic to algae, Medaka and hERG, whereas immunotoxicity was only positive for myrcene. Considering the regular performance in the other parameters, and the low inhibitory potential for CYP's, the most promising molecules are α-pinene and δ-3-carene. However, further toxicity studies are important. |
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Schinus terebinthifolius Raddi: a literature review associated with an in silico studySchinus terebinthifolius Raddi: una revisión bibliográfica asociada a un estudio in silicoSchinus terebinthifolius Raddi: uma revisão bibliográfica associada a um estudo in silicoAroeiraTerpenosPropriedades farmacológicas.AroeiraTerpenesPharmacological properties.AroeiraTerpenosPropiedades farmacológicas.The present work gathered studies in the literature about the biological activities of Schinus terebinthifolius and evaluated possible physicochemical, pharmacokinetic, and toxicity characteristics of molecules isolated from this species. Initially, a broad literature review was conducted using the following databases: Google Scholar, Portal de Periódicos Capes, SciELO and PubMed, with the descriptors: "Schinus terebinthifolius Raddi", "pharmacological properties", "isolated compounds", including studies published in Portuguese and English between the years 2001 and The selected molecules were designed in MarvinSketch software and submitted to PreADMET and Protox II software. Regarding the biological studies, the literature revealed that S. terebinthifolius has the activities: anti-inflammatory, wound healing, anti-ulcer, antibacterial, antifungal, antioxidant, antihistaminic, larvicidal, insecticidal, and repellent. The chemical studies showed that S. terebinthifolius has a significant amount of terpenes, especially monoterpenes and sesquiterpenes. The following molecules were selected: limonene, α-pinene, β-pinene, α-felandrene, δ-3-carene, germacrene D, myrcene, and o-cymene. The literature concerning S. terebinthifolius demonstrates how this plant has an extensive framework of activities. It was observed that the molecules presented advantages and disadvantages in physicochemical, pharmacokinetic and toxicological parameters. In general, all molecules followed Lipinski's rule, and all molecules were toxic to algae, Medaka and hERG, whereas immunotoxicity was only positive for myrcene. Considering the regular performance in the other parameters, and the low inhibitory potential for CYP's, the most promising molecules are α-pinene and δ-3-carene. However, further toxicity studies are important. El presente trabajo reunió en la literatura estudios sobre las actividades biológicas de Schinus terebinthifolius y evaluó las posibles características fisicoquímicas, farmacocinéticas y de toxicidad de las moléculas aisladas de esta especie. Inicialmente, se realizó una amplia revisión bibliográfica utilizando las siguientes bases de datos: Google Scholar, Portal de Periódicos Capes, SciELO y PubMed, con los descriptores: "Schinus terebinthifolius Raddi", "propiedades farmacológicas", "compuestos aislados", incluyendo estudios publicados en portugués e inglés entre los años 2001 y 2022. Las moléculas seleccionadas fueron diseñadas en el software MarvinSketch y se sometieron a los programas PreADMET y Protox II. En cuanto a los estudios biológicos, la literatura reveló que S. terebinthifolius presenta las siguientes actividades: antiinflamatoria, cicatrizante, antiulcerosa, antibacteriana, antifúngica, antioxidante, antihistamínica, larvicida, insecticida y repelente. Los estudios químicos mostraron que S. terebinthifolius tiene una cantidad significativa de terpenos, especialmente monoterpenos y sesquiterpenos. Se seleccionaron las siguientes moléculas: limoneno, α-pineno, β-pineno, α-felandreno, δ-3-careno, germacreno D, mirceno y o-cimeno. La literatura sobre S. terebinthifolius demuestra cómo esta planta tiene un amplio marco de actividades. Se observó que las moléculas presentaron ventajas y desventajas en parámetros fisicoquímicos, farmacocinéticos y toxicológicos. En general, todas las moléculas siguieron la regla de Lipinski y todas fueron tóxicas para las algas, Medaka y hERG, mientras que la inmunotoxicidad solo fue positiva para el mirceno. Considerando el desempeño regular en los demás parámetros y el bajo potencial inhibidor de CYP, las moléculas más prometedoras son el α-pineno y el δ-3-careno. Sin embargo, es importante realizar más estudios de toxicidad.O presente trabalho reuniu na literatura estudos acerca das atividades biológicas da Schinus terebinthifolius e avaliou possíveis características físico-químicas, farmacocinéticas e de toxicidade de moléculas isoladas desta espécie. Inicialmente, se realizou uma ampla revisão de literatura, por meio das bases de dados: Google Acadêmico, Portal de Periódicos Capes, SciELO e PubMed, com os descritores: “Schinus terebinthifolius Raddi”, “propriedades farmacológicas”, “compostos isolados”, incluindo estudos publicados em português e inglês entre os anos de 2001 a 2022. As moléculas selecionadas foram desenhadas no software MarvinSketch e submetidas aos programas PreADMET e Protox II. Em relação aos estudos biológicos, a literatura revelou que a S. terebinthifolius apresenta as atividades: anti-inflamatória, cicatrizante, antiulcerativa, antibacteriana, antifúngica, antioxidante, anti-histamínica, larvicida, inseticida e repelente. Os estudos químicos apontaram que a S. terebinthifolius possui uma quantidade expressiva de terpenos, especialmente monoterpenos e sesquiterpenos. Foram selecionadas as moléculas: limoneno, α-pineno, β-pineno, α-felandreno, δ-3-careno, germacreno D, mirceno e o-cimeno. A literatura referente a S. terebinthifolius demonstra como esta planta possui um extenso arcabouço de atividades. Foi observado que as moléculas apresentaram vantagens e desvantagens em parâmetros físico-químicos, farmacocinéticos e toxicológicos. De modo geral, todas as moléculas seguiram a regra de Lipinski, e todas se mostraram tóxicas para algas, Medaka e hERG, enquanto que a imunotoxicidade só foi positiva para o mirceno. Considerando o desempenho regular nos demais parâmetros, e o baixo potencial inibitório para as CYP’s, as moléculas mais promissoras são α-pineno e δ-3-careno. Entretanto, novos estudos de toxicidade são importantes.Research, Society and Development2022-09-19info:eu-repo/semantics/articleinfo:eu-repo/semantics/publishedVersionapplication/pdfhttps://rsdjournal.org/index.php/rsd/article/view/3426210.33448/rsd-v11i12.34262Research, Society and Development; Vol. 11 No. 12; e421111234262Research, Society and Development; Vol. 11 Núm. 12; e421111234262Research, Society and Development; v. 11 n. 12; e4211112342622525-3409reponame:Research, Society and Developmentinstname:Universidade Federal de Itajubá (UNIFEI)instacron:UNIFEIporhttps://rsdjournal.org/index.php/rsd/article/view/34262/29226Copyright (c) 2022 Hanna de Oeiras Ramos; Gleison Gonçalves Ferreira; Dayse Lúcia do Nascimento Brandão; Maria Fani Dolabelahttps://creativecommons.org/licenses/by/4.0info:eu-repo/semantics/openAccessRamos, Hanna de OeirasFerreira, Gleison GonçalvesBrandão, Dayse Lúcia do NascimentoDolabela, Maria Fani2022-09-26T11:56:08Zoai:ojs.pkp.sfu.ca:article/34262Revistahttps://rsdjournal.org/index.php/rsd/indexPUBhttps://rsdjournal.org/index.php/rsd/oairsd.articles@gmail.com2525-34092525-3409opendoar:2024-01-17T09:49:38.254083Research, Society and Development - Universidade Federal de Itajubá (UNIFEI)false |
dc.title.none.fl_str_mv |
Schinus terebinthifolius Raddi: a literature review associated with an in silico study Schinus terebinthifolius Raddi: una revisión bibliográfica asociada a un estudio in silico Schinus terebinthifolius Raddi: uma revisão bibliográfica associada a um estudo in silico |
title |
Schinus terebinthifolius Raddi: a literature review associated with an in silico study |
spellingShingle |
Schinus terebinthifolius Raddi: a literature review associated with an in silico study Ramos, Hanna de Oeiras Aroeira Terpenos Propriedades farmacológicas. Aroeira Terpenes Pharmacological properties. Aroeira Terpenos Propiedades farmacológicas. |
title_short |
Schinus terebinthifolius Raddi: a literature review associated with an in silico study |
title_full |
Schinus terebinthifolius Raddi: a literature review associated with an in silico study |
title_fullStr |
Schinus terebinthifolius Raddi: a literature review associated with an in silico study |
title_full_unstemmed |
Schinus terebinthifolius Raddi: a literature review associated with an in silico study |
title_sort |
Schinus terebinthifolius Raddi: a literature review associated with an in silico study |
author |
Ramos, Hanna de Oeiras |
author_facet |
Ramos, Hanna de Oeiras Ferreira, Gleison Gonçalves Brandão, Dayse Lúcia do Nascimento Dolabela, Maria Fani |
author_role |
author |
author2 |
Ferreira, Gleison Gonçalves Brandão, Dayse Lúcia do Nascimento Dolabela, Maria Fani |
author2_role |
author author author |
dc.contributor.author.fl_str_mv |
Ramos, Hanna de Oeiras Ferreira, Gleison Gonçalves Brandão, Dayse Lúcia do Nascimento Dolabela, Maria Fani |
dc.subject.por.fl_str_mv |
Aroeira Terpenos Propriedades farmacológicas. Aroeira Terpenes Pharmacological properties. Aroeira Terpenos Propiedades farmacológicas. |
topic |
Aroeira Terpenos Propriedades farmacológicas. Aroeira Terpenes Pharmacological properties. Aroeira Terpenos Propiedades farmacológicas. |
description |
The present work gathered studies in the literature about the biological activities of Schinus terebinthifolius and evaluated possible physicochemical, pharmacokinetic, and toxicity characteristics of molecules isolated from this species. Initially, a broad literature review was conducted using the following databases: Google Scholar, Portal de Periódicos Capes, SciELO and PubMed, with the descriptors: "Schinus terebinthifolius Raddi", "pharmacological properties", "isolated compounds", including studies published in Portuguese and English between the years 2001 and The selected molecules were designed in MarvinSketch software and submitted to PreADMET and Protox II software. Regarding the biological studies, the literature revealed that S. terebinthifolius has the activities: anti-inflammatory, wound healing, anti-ulcer, antibacterial, antifungal, antioxidant, antihistaminic, larvicidal, insecticidal, and repellent. The chemical studies showed that S. terebinthifolius has a significant amount of terpenes, especially monoterpenes and sesquiterpenes. The following molecules were selected: limonene, α-pinene, β-pinene, α-felandrene, δ-3-carene, germacrene D, myrcene, and o-cymene. The literature concerning S. terebinthifolius demonstrates how this plant has an extensive framework of activities. It was observed that the molecules presented advantages and disadvantages in physicochemical, pharmacokinetic and toxicological parameters. In general, all molecules followed Lipinski's rule, and all molecules were toxic to algae, Medaka and hERG, whereas immunotoxicity was only positive for myrcene. Considering the regular performance in the other parameters, and the low inhibitory potential for CYP's, the most promising molecules are α-pinene and δ-3-carene. However, further toxicity studies are important. |
publishDate |
2022 |
dc.date.none.fl_str_mv |
2022-09-19 |
dc.type.driver.fl_str_mv |
info:eu-repo/semantics/article info:eu-repo/semantics/publishedVersion |
format |
article |
status_str |
publishedVersion |
dc.identifier.uri.fl_str_mv |
https://rsdjournal.org/index.php/rsd/article/view/34262 10.33448/rsd-v11i12.34262 |
url |
https://rsdjournal.org/index.php/rsd/article/view/34262 |
identifier_str_mv |
10.33448/rsd-v11i12.34262 |
dc.language.iso.fl_str_mv |
por |
language |
por |
dc.relation.none.fl_str_mv |
https://rsdjournal.org/index.php/rsd/article/view/34262/29226 |
dc.rights.driver.fl_str_mv |
https://creativecommons.org/licenses/by/4.0 info:eu-repo/semantics/openAccess |
rights_invalid_str_mv |
https://creativecommons.org/licenses/by/4.0 |
eu_rights_str_mv |
openAccess |
dc.format.none.fl_str_mv |
application/pdf |
dc.publisher.none.fl_str_mv |
Research, Society and Development |
publisher.none.fl_str_mv |
Research, Society and Development |
dc.source.none.fl_str_mv |
Research, Society and Development; Vol. 11 No. 12; e421111234262 Research, Society and Development; Vol. 11 Núm. 12; e421111234262 Research, Society and Development; v. 11 n. 12; e421111234262 2525-3409 reponame:Research, Society and Development instname:Universidade Federal de Itajubá (UNIFEI) instacron:UNIFEI |
instname_str |
Universidade Federal de Itajubá (UNIFEI) |
instacron_str |
UNIFEI |
institution |
UNIFEI |
reponame_str |
Research, Society and Development |
collection |
Research, Society and Development |
repository.name.fl_str_mv |
Research, Society and Development - Universidade Federal de Itajubá (UNIFEI) |
repository.mail.fl_str_mv |
rsd.articles@gmail.com |
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1797052722404392960 |