Your browser doesn't support javascript.
loading
Mostrar: 20 | 50 | 100
Resultados 1 - 20 de 103
Filtrar
1.
Vaccines (Basel) ; 12(4)2024 Apr 10.
Artículo en Inglés | MEDLINE | ID: mdl-38675785

RESUMEN

Acaricides are the most widely used method to control the cattle tick Rhipicephalus microplus. However, its use increases production costs, contaminates food and the environment, and directly affects animal and human health. The intensive use of chemical control has resulted in the selection of genes associated with resistance to acaricides, and consumers are increasingly less tolerant of food contamination. This scenario has increased the interest of different research groups around the world for anti-tick vaccine development, in order to reduce the environmental impact, the presence of residues in food, and the harmful effects on animal and human health. There is enough evidence that vaccination with tick antigens induces protection against tick infestations, reducing tick populations and acaricide treatments. Despite the need for an anti-tick vaccine in Mexico, vaccination against ticks has been limited to one vaccine that is used in some regions. The aim of this review is to contribute to the discussion on tick control issues and provide a reference for readers interested in the importance of using anti-tick vaccines encouraging concerted action on the part of Mexican animal health authorities, livestock organizations, cattle producers, and academics. Therefore, it is suggested that an anti-tick vaccine should be included as a part of an integrated tick management program in Mexico.

3.
Methods Mol Biol ; 2758: 401-423, 2024.
Artículo en Inglés | MEDLINE | ID: mdl-38549027

RESUMEN

Peptides have potential bioactive functions, and the peptidomics landscape has been broadly investigated for various diseases, including cancer. In this chapter, we reviewed the past four years of literature available and selected 16 peer-reviewed publications exploring peptidomics in diagnosis, prognosis, and treatment in cancer research. We highlighted their main aims, mass spectrometry-based peptidomics, multi-omics, data-driven and in silico strategies, functional assays, and clinical applications. Moreover, we underscored several levels of difficulties in translating the peptidomics findings to clinical practice, aiming to learn with the accumulated knowledge and guide upcoming studies. Finally, this review reinforces the peptidomics robustness in discovering potential candidates for monitoring the several stages of cancer disease and therapeutic treatment, leveraging the management of cancer patients in the future.


Asunto(s)
Neoplasias , Proteómica , Humanos , Péptidos/uso terapéutico , Espectrometría de Masas , Neoplasias/diagnóstico , Neoplasias/terapia
4.
Front Microbiol ; 14: 1207664, 2023.
Artículo en Inglés | MEDLINE | ID: mdl-37965564

RESUMEN

The consumption of non-steroidal anti-inflammatory drugs (NSAIDs) have increased significantly in the last years (2020-2022), especially for patients in COVID-19 treatment. NSAIDs such as diclofenac, ibuprofen, and paracetamol are often available without restrictions, being employed without medical supervision for basic symptoms of inflammatory processes. Furthermore, these compounds are increasingly present in nature constituting complex mixtures discarded at domestic and hospital sewage/wastewater. Therefore, this review emphasizes the biodegradation of diclofenac, ibuprofen, and paracetamol by pure cultures or consortia of fungi and bacteria at in vitro, in situ, and ex situ processes. Considering the influence of different factors (inoculum dose, pH, temperature, co-factors, reaction time, and microbial isolation medium) relevant for the identification of highly efficient alternatives for pharmaceuticals decontamination, since biologically active micropollutants became a worldwide issue that should be carefully addressed. In addition, we present a quantitative bibliometric survey, which reinforces that the consumption of these drugs and consequently their impact on the environment goes beyond the epidemiological control of COVID-19.

5.
J Anim Physiol Anim Nutr (Berl) ; 107(4): 1019-1027, 2023 Jul.
Artículo en Inglés | MEDLINE | ID: mdl-36524550

RESUMEN

This study was conducted to investigate if calves supplemented with rice bran in a creep feeding (CF) system associated with temporary weaning (TW) affects the performance of the cow-calf pair grazing natural grasslands during summer. Two experiments were performed using 275 cow-calf pairs of British breeds and their crosses of different parities (primiparous [n = 188] in Experiment 1 and multiparous [n = 87] in Experiment 2). In both experiments, the factors evaluated were: (1) supplementation of calves with rice bran using CF: yes (+CF) or no (-CF); (2) TW for 14 days using nose plates: yes (+TW) or no (-TW). Four experimental groups were formed in both experiments: -CF - TW, -CF + TW, +CF - TW and +CF + TW. TW decreased the average daily weight gain and live weight of calves independently of the age of their mothers. The use of CF decreased both of these parameters in calves born to primiparous cows, and there was no response in the case of calves born to multiparous cows. A greater proportion of primiparous cows that received +CF conceived in the first 21 days of mating (+CF - TW = 63.5% and +CF + TW = 50%) than the other groups. The final pregnancy rate was similar among groups in both experiments. In conclusion, TW decreased the average daily weight gain and weaning weight of calves. Supplementation of calves born to primiparous cows with rice bran decreased their daily weight gain during the period of TW and their weaning weight, but their dams were conceived earlier.


Asunto(s)
Oryza , Embarazo , Femenino , Animales , Bovinos , Destete , Fitomejoramiento , Suplementos Dietéticos , Aumento de Peso
6.
Rev. bras. oftalmol ; 82: e0003, 2023. tab
Artículo en Inglés | LILACS-Express | LILACS | ID: biblio-1423621

RESUMEN

ABSTRACT Objective: To evaluate the effectiveness of text messaging in improving adherence to occlusion therapy for amblyopia. The secondary objective was to correlate the responses given in a self-reporting questionnaire with treatment outcome (improvement in visual acuity). Methods: This is a prospective, randomized, blinded clinical trial. The patients' parents or legal guardians in the intervention group received text messages reminding them of the importance of patching. The control group received no text messages. At final evaluation, after a period of three to six months, the patients' parents or legal guardians answered a self-reporting questionnaire to evaluate adherence to treatment. Results: The study included 34 patients with an average age of 5.35 years, 20 in the intervention group and 14 in the control group. According to the results of the self-reporting questionnaire, 50% of the study population was considered as having low adherence to treatment, 29% as having medium adherence, and 21% as having good adherence. There was no significant difference between trial groups. The comparison between an improvement in visual acuity and the mean value obtained in the self-reporting questionnaire showed a significant association between this improvement and adherence to treatment (p=0.03). Conclusion: The present study did not find a correlation between text messaging and an improvement in adherence to occlusion therapy, as shown by previous studies for different treatments. A statistically significant association was identified between an improvement in visual acuity and a good therapeutic adherence, as measured by the self-reporting questionnaire. This finding allows us to recommend using a self-reporting questionnaire as a simple method to measure adherence to treatment and help decisions about therapeutic strategies to be adopted in the patient's continuing treatment.


RESUMO Objetivo: Avaliar a eficácia do envio de mensagens de texto na melhora da adesão ao tratamento oclusivo da ambliopia. O objetivo secundário foi correlacionar as respostas dadas no questionário autorreportado e os resultados obtidos no tratamento (melhora da acuidade visual). Métodos: Ensaio clínico prospectivo, mascarado e randomizado. Os pais ou responsáveis legais dos pacientes no grupo intervenção receberam mensagens de texto para lembrar a importância dos oclusores. O grupo controle não recebeu mensagens. Na avaliação geral após 3 a 6 meses, os responsáveis responderam a um questionário autorreportado para avaliar a aderência ao tratamento. Resultados: Foram incluídos 34 pacientes com idade média de 5,35 anos; 20 eram do grupo intervenção. A população do estudo foi considerada 50% pouco aderente ao tratamento, 29% com aderência média e 21% com boa aderência, de acordo com resultado do questionário autorreportado. Não houve diferença significativa entre os grupos estudados. Quando comparada a relação entre a melhora da acuidade visual com o valor médio do questionário autorreportado, foi observada associação significativa da melhora com a adesão ao tratamento (p=0,03). Conclusão: Este estudo não mostrou melhora da aderência ao tratamento oclusivo com o envio de mensagens de texto, como tinha sido observado em estudos anteriores para outros tratamentos. Foi identificada uma relação estatisticamente significativa entre a melhora na acuidade visual e boa aderência terapêutica medida pelo questionário autorreportado. Isso permite recomendar o uso do questionário autorreportado como uma forma simples de mensurar aderência ao tratamento e auxiliar nas decisões sobre estratégias a serem adotadas na continuidade do seguimento do paciente.

8.
Toxicol Rep ; 9: 1537-1547, 2022.
Artículo en Inglés | MEDLINE | ID: mdl-36518414

RESUMEN

Intestinal mucositis (IM) is a frequent adverse effect in anticancer therapy without standard treatment. The oil obtained from sucupira (Pterodon emarginatus) has anti-inflammatory properties, and the soybean lecithin reduces the intestinal toxicity of several xenobiotics. However, their water insolubility impairs the in vivo application. For this reason, we evaluated if the nanoencapsulation of sucupira oil (SO) in lecithin-based nanocapsules (SO-NC) could be a therapeutically effective system for the treatment of IM in murine cisplatin (CDDP)-induced intestinal mucositis model. SO was analyzed by LC-HRMS/MS and HPLC. SO-NC was prepared by nanoprecipitation and characterized using DLS, HPLC, and AFM. Mice body weight and food consumption were assessed daily during experimental mucositis induced by CDDP. The animals were euthanized, and intestinal permeability, inflammatory mediators, and intestinal histology were performed. SO-NC demonstrated adequate characteristics for oral administration as size under 300 nm, IP < 0.3, high EE, and spherical shape. In vitro cytotoxicity performed against RAW 264.7 cell lines resulted in cell viability above 80 % confirming the non-cytotoxic profile of SO (IC50 268 µg/mL) and SO-NC (IC50 118.5 µg/mL) up to 117.2 µg/mL. The untreated mice showed intestinal toxicity after i.p. of CDDP, principally weight loss, increased intestinal permeability, and MPO and TNF-α levels. Surprisingly, the administration of SO to CDDP-mucositis animals did not circumvent the CDDP effects and increased intestinal permeability. However, SO-NC proved efficient in mitigating the experimental intestinal mucositis by improving intestinal epithelium architecture, reducing intestinal permeability, and improving the MPO levels. In conclusion, SO-NC can positively impact intestinal mucositis by promoting mucosal recovery. This is a promising strategy for developing a new treatment for intestinal mucositis.

9.
Molecules ; 27(23)2022 Dec 02.
Artículo en Inglés | MEDLINE | ID: mdl-36500534

RESUMEN

Mosquitoes can be vectors of pathogens and transmit diseases to both animals and humans. Species of the genus Culex are part of the cycle of neglected diseases, especially Culex quinquefasciatus, which is an anthropophilic vector of lymphatic filariasis. Natural products can be an alternative to synthetic insecticides for vector control; however, the main issue is the poor water availability of some compounds from plant origin. In this context, nanoemulsions are kinetic stable delivery systems of great interest for lipophilic substances. The objective of this study was to investigate the larvicidal activity of the Hyptis suaveolens essential oil nanoemulsion on Cx. quinquefasciatus. The essential oil showed a predominance of monoterpenes with retention time (RT) lower than 15 min. The average size diameter of the emulsions (sorbitan monooleate/polysorbate 20) was ≤ 200 nm. The nanoemulsion showed high larvicidal activity in concentrations of 250 and 125 ppm. CL50 values were 102.41 (77.5253−149.14) ppm and 70.8105 (44.5282−109.811) ppm after 24 and 48 h, respectively. The mortality rate in the surfactant control was lower than 9%. Scanning micrograph images showed changes in the larvae's integument. This study achieved an active nanoemulsion on Cx. quinquefasciatus through a low-energy-input technique and without using potentially toxic organic solvents. Therefore, it expands the scope of possible applications of H. suaveolens essential oil in the production of high-added-value nanosystems for tropical disease vector control.


Asunto(s)
Aedes , Culex , Culicidae , Insecticidas , Lamiaceae , Aceites Volátiles , Humanos , Animales , Aceites Volátiles/farmacología , Aceites Volátiles/análisis , Larva , Mosquitos Vectores , Insecticidas/química , Extractos Vegetales/química , Hojas de la Planta/química
10.
Licere (Online) ; 25(2): 233-260, set.2022. ilus
Artículo en Portugués | LILACS | ID: biblio-1399744

RESUMEN

Este artigo objetiva apresentar uma revisão das produções acadêmicas de algumas correntes teórico-metodológicas, denominadas de "escolas", que abordam o jogo na Educação Física brasileira. Trata-se de uma pesquisa de abordagem qualitativa, de cunho descritivo, do tipo bibliográfico. Os critérios de inclusão para definir as "escolas" foram: tradição de pesquisas produzidas por mais de uma década, formação profissional em grupos de pesquisa com orientações na graduação e pós-graduação e com contribuições didáticas e investigativas utilizadas como referências na área. A análise de conteúdo das obras principais (livros) deu-se a partir das unidades temáticas: educação escolar, esporte e lazer. O estudo identificou quatro escolas, assim denominadas: Jogo, entre a rua e a escola; Jogo Tradicional; Praxiologia Motriz do jogo e Escola Brincante. Neste artigo, está abordado o conceito de jogo e as contribuições das produções bibliográficas para a educação escolar, para o esporte e para o lazer, das duas primeiras escolas.


This article aims to present a review of the academic productions of some theoretical-methodological currents, called "schools", which approach the game in Brazilian Physical Education. This is a qualitative, descriptive, bibliographic research. The inclusion criteria to define the "schools" were: tradition of the researches produced for more than a decade, professional training in research groups with guidance at undergraduate and postgraduate levels and with didactic and investigative contributions used as references in the area. The content analysis of the main works (books) was based on the thematic units: school education, sport and leisure. The study identified four schools, named as follows: Game, between the street and the school; Traditional Game; Game Driving Praxiology and Playing School. In this article, the concept of game and the contributions of bibliographic productions for school education, for sport and for leisure, from the first two schools are discussed.


Asunto(s)
Educación
11.
Toxicol Res (Camb) ; 11(3): 520-528, 2022 Jun.
Artículo en Inglés | MEDLINE | ID: mdl-35782641

RESUMEN

Kefiran is a polysaccharide present in kefir grains that have been widely explored due to its potential health benefits. The objective of this work was to characterize and quantify the components present in the ethanolic extract of milk kefir grains; to study its pharmacokinetic and toxicological properties in silico and evaluate the acute toxicity of the kefiran in zebrafish. The prediction of pharmacokinetic properties was performed by QikProp software. In silico toxicity assessment was performed using the DEREK (deductive estimate of risk from existing knowledge) software. In the chromatographic, kefiran was identified as the major component. Results showed that the kefiran had low human oral absorption and intestinal absorption its due poor solubility profile; low logP value, indicating its lipophilicity and the low MDCK and Caco-2 cells permability, and unable to cross the blood-brain barrier. Kefiran did not present any structural warning for in silico toxicity. In zebrafish, the dose of 2,000 mg/kg of kefiran produced nonsignificant alterations in the analyzed organs. It can be said then that kefiran has an acceptable degree of safety for use in the development of drugs or functional foods. Further research such as in vivo testing to confirm its pharmacological potential is currently underway.

12.
Rev Chilena Infectol ; 39(2): 218-220, 2022 04.
Artículo en Español | MEDLINE | ID: mdl-35856997

RESUMEN

There are few cases reports of Enterobacter cancerogenus infections. Although it has been isolated in contaminated wounds associated with trauma, it has also been reported as an etiological agent in a wide variety of other infections, with the presence of bacteremia being infrequent. We present the first case reported in Chile of a bacteremia caused by this agent, in a 28-year-old patient with a stable pelvic fracture due a high-energy traffic accident. He had a good clinical response to treatment with ertapenem.


Asunto(s)
Bacteriemia , Infecciones por Enterobacteriaceae , Adulto , Bacteriemia/tratamiento farmacológico , Chile , Enterobacter , Infecciones por Enterobacteriaceae/tratamiento farmacológico , Ertapenem , Humanos , Masculino
13.
Iran J Allergy Asthma Immunol ; 21(1): 98-100, 2022 Feb 06.
Artículo en Inglés | MEDLINE | ID: mdl-35524384

RESUMEN

Cold-induced urticaria is considered as a subtype of physical urticaria and also the second most common type of chronic inducible urticaria. Contact with cold surfaces or the environment may cause systemic reactions, especially during aquatic activities. A 22-year-old female patient with a history of sulfa drug allergy began her condition 2 years before the presence of generalized pruritic erythema with hives as well as 2 episodes that had been characterized by facial angioedema and syncope 3-5 minutes after being in contact with cold air or surfaces.  On both events, she had just been outdoors on a cold, winter day. She was suspected to have cold-induced urticaria; thereby she had a positive reaction to the ice cube test. Due to the previous episodes of anaphylaxis, the patient was trained to administer intramuscular epinephrine. After 4 weeks of starting the treatment with antihistamines, no new events or injuries had occurred. Cold-induced urticaria may cause life-threatening reactions. The rate of anaphylaxis in these patients is low however, this case is presented to inform the importance of identifying this type of systemic reaction and preventing strategies.


Asunto(s)
Anafilaxia , Angioedema , Urticaria Crónica , Urticaria , Adulto , Anafilaxia/diagnóstico , Anafilaxia/etiología , Angioedema/diagnóstico , Angioedema/tratamiento farmacológico , Angioedema/etiología , Cara , Femenino , Humanos , Urticaria/diagnóstico , Urticaria/etiología , Adulto Joven
14.
Rev. chil. infectol ; Rev. chil. infectol;39(2): 218-220, abr. 2022. ilus
Artículo en Español | LILACS | ID: biblio-1388346

RESUMEN

Resumen Existen escasas comunicaciones de infecciones por Enterobacter cancerogenus. Aunque ha sido aislado en heridas contaminadas asociadas a traumas, también ha sido reportado como agente etiológico en una amplia variedad de otras infecciones, siendo infrecuente la presencia de bacteriemia. Presentamos el primer caso reportado en Chile de una bacteriemia causada por este microorganismo, en un varón de 28 años con una fractura de pelvis estable debido a un accidente de tránsito de alta energía. Tuvo una buena respuesta clínica al tratamiento con ertapenem.


Abstract There are few cases reports of Enterobacter cancerogenus infections. Although it has been isolated in contaminated wounds associated with trauma, it has also been reported as an etiological agent in a wide variety of other infections, with the presence of bacteremia being infrequent. We present the first case reported in Chile of a bacteremia caused by this agent, in a 28-year-old patient with a stable pelvic fracture due a high-energy traffic accident. He had a good clinical response to treatment with ertapenem.


Asunto(s)
Humanos , Masculino , Adulto , Bacteriemia/tratamiento farmacológico , Infecciones por Enterobacteriaceae/tratamiento farmacológico , Chile , Enterobacter , Ertapenem
15.
J Oncol Pharm Pract ; 28(3): 598-604, 2022 Apr.
Artículo en Inglés | MEDLINE | ID: mdl-33847195

RESUMEN

BACKGROUND: Taxanes adjuvant therapy is recommended in certain high risk or metastatic tumors, particularly in lung and breast cancer, but also in other types of cancer like ovarian. The incidence of severe adverse drug reactions to paclitaxel is of approximately 10%. OBJECTIVES: Analyze type I hypersensitivity reactions to paclitaxel and their management in the Mexican population. METHOD: It is a retrospective, observational and descriptive study that included type I hypersensitivity reactions to paclitaxel reported from our database. Symptoms of hypersensitivity reactions to paclitaxel were classified and skin testing was performed with a 6 mg/mL paclitaxel concentration. The desensitization procedure consisted of a 12-steps, 3-bags of 250 mL protocol with a 6-7-hour duration. RESULTS: A total of 60 desensitization procedures were performed and were all completed successfully. All participants in our group were female, their median age was 44.5 years.All of our patients had hypersensitivity adverse drug reaction to paclitaxel during their first exposure and within the first 10 minutes of infusion. 63.6% of the patients had a moderate hypersensitivity reaction to paclitaxel and 36.4% had a severe reaction. CONCLUSIONS: Paclitaxel continues to be a common use drug and has a high rate of adverse drug reactions. This is the first study of hypersensitivity to paclitaxel in a Mexican population.


Asunto(s)
Neoplasias de la Mama , Hipersensibilidad a las Drogas , Efectos Colaterales y Reacciones Adversas Relacionados con Medicamentos , Hipersensibilidad Inmediata , Adulto , Neoplasias de la Mama/complicaciones , Desensibilización Inmunológica/métodos , Hipersensibilidad a las Drogas/etiología , Hipersensibilidad a las Drogas/terapia , Femenino , Humanos , Hipersensibilidad Inmediata/inducido químicamente , Hipersensibilidad Inmediata/complicaciones , Masculino , Paclitaxel/efectos adversos , Estudios Retrospectivos
16.
Bol. micol. (Valparaiso En linea) ; 36(2): 1-4, dic. 2021.
Artículo en Español | LILACS | ID: biblio-1352521

RESUMEN

Al 16 de julio pasado existían 108 vacunas en etapa clínica de desarrollo, 28 de ellas con estudios en fase III y 6 autorizadas por la Organización Mundial de la Salud (OMS) según datos publicados al 3 de junio (AstraZeneca/Oxford, Johnson and Johnson/Janssen, Moderna, Pfizer/BionTech, Sinopharm, Sinovac) (1,2). A la vez, las entidades regulatorias como la FDA (Food and Drugs Agency) y la EMA (European Medicine Agency) han autorizado para uso de emergencia las vacunas de los productores Pfizer/BioNTech, Moderna, AstraZeneca y Janssen (3) y en Chile el Instituto de Salud Pública ha autorizado 6 vacunas (Pfizer, CoronaVac, Astrazeneca, CanSino, Janssen, Sputnik). En las últimas semanas, en el contexto de la preocupante propagación de la variante Delta (B.1.617.2) del SARS-CoV-2, la compañía Pfizer solicitó a la FDA la autorización para la administración de una dosis de refuerzo (booster) con su vacuna BNT162b2 , luego de que el análisis interino de datos provenientes de la población vacunada en Israel mostrará una reducción significativa de los anticuerpos neutralizantes a los seis meses de completado el esquema primario, solicitud que generó debate en la comunidad científica. Hasta ahora los datos disponibles sobre eficacia de la vacuna BNT162b2 en escenario de circulación de variantes sugieren que continúa siendo altamente efectiva (4,5). Los estudios para definir la eventual necesidad de una dosis de refuerzo a diferentes esquemas primarios están en etapas de reclutamiento inicial en varios países.(AU)


Asunto(s)
Vacunas contra la COVID-19/uso terapéutico , COVID-19/prevención & control , Dosis Repetida , Chile , Eficacia
17.
Breast Cancer Res Treat ; 188(2): 525-533, 2021 Jul.
Artículo en Inglés | MEDLINE | ID: mdl-33683522

RESUMEN

PURPOSE: Increasingly epidemiological evidence supports that environmental factors are associated with breast cancer (BC) outcomes after a BC diagnosis. Although evidence suggests that air pollution exposure is associated with higher mortality in women with BC, studies investigating potential mechanisms have been lacking. METHODS: We evaluated women with BC (N = 151) attended at the National Cancer Institute-Mexico from 2012 to 2015. We calculated 1-year average exposures to particulate matter < 2.5 µm (PM2.5) at home address before diagnosis. We used linear and logistic regression models to determine the associations between PM2.5 exposure and BC aggressiveness (tumor size, molecular phenotype). RESULTS: Average annual PM2.5 exposure of this population was 23.0 µg/m3 [standard deviation (SD)]: 1.90 µg/m3]. PM2.5 levels were positively correlated with tumor size at diagnosis (r = 0.22; p = 0.007). Multivariable linear models had a similar inference [risk ratio (RR): 1.32; 95% confidence interval (95% CI): 1.04, 1.674]. We did not observe differences in this association by age or menopause status. Further, women with triple-negative BC (TNBC) had significantly higher PM2.5 levels compared with other phenotypes (p = 0.015). Multivariable-adjusted logistic regression models assessing the association between PM2.5 and tumor size had a similar inference (RR 1.41; 95% CI 1.05, 1.89) overall for all ages and also for women who were ≤ 50 years old at diagnosis (RR 1.63; 95% CI 1.036, 2.57). CONCLUSIONS: Our findings suggest a significant association between long-term PM2.5 exposure and BC aggressiveness based on tumor size and phenotype, as well as a worse outcome.


Asunto(s)
Contaminantes Atmosféricos , Contaminación del Aire , Neoplasias de la Mama , Contaminantes Atmosféricos/efectos adversos , Contaminantes Atmosféricos/análisis , Contaminación del Aire/efectos adversos , Contaminación del Aire/análisis , Neoplasias de la Mama/diagnóstico , Neoplasias de la Mama/epidemiología , Exposición a Riesgos Ambientales/efectos adversos , Exposición a Riesgos Ambientales/análisis , Femenino , Humanos , México , Persona de Mediana Edad , Material Particulado/efectos adversos , Material Particulado/análisis
18.
Curr Comput Aided Drug Des ; 17(4): 589-617, 2021.
Artículo en Inglés | MEDLINE | ID: mdl-32560610

RESUMEN

BACKGROUND: Euterpe oleracea Martius, popularly known as açaí, is a fruit rich in α- tocopherols, fibers, lipids, mineral ions, and polyphenols. It is believed that the high content of polyphenols, especially flavonoids, provides several health-promoting effects to the açaí fruit, including anti-inflammatory, immunomodulatory, antinociceptive and antioxidant properties. Most of the flavonoids are antioxidant molecules of plant origin that act as a trap for free radicals, reacting and neutralizing them, thus offering perspectives in preventing oxidative damage. OBJECTIVE: In this study, we aim to perform an in silico evaluation of flavonoids present in the pulp and the oil of Euterpe oleracea Martius, evaluating their potential to serve as antioxidant agents. METHODS: Firstly, we selected 16 flavonoids present in Euterpe oleracea Martius pulp and oil, and then their physicochemical properties were analyzed concerning the Lipinski's Rule of Five. Moreover, we evaluated their pharmacokinetic properties using the QikProp module of the Schrödinger software as well as their toxicity profile, using the DEREK software. Docking simulations, using the GOLD 4.1 software, as well as pharmacophoric hypotheses calculation of molecules were also performed. RESULTS: Flavonoids present in the açaí pulp including catechin, epicatechin, luteolin, chrisoeriol, taxifolin, apigenin, dihydrokaempferol, isovitexin, and vitexin presented good oral bioavailability. Regarding the pharmacokinetic properties, the compounds catechin, epicatechin, isovitexin, luteolin, chrisoeriol, taxifolin, and isorhamnetin rutinoside presented the best results, besides high human oral absorption. Regarding the prediction of toxicological properties, compounds isorhamnetin rutinoside and rutin presented mutagenicity for hydroxynaphthalene or derivate, and regarding the docking simulations, all the compounds investigated in this study presented key interactions with the corresponding targets. CONCLUSION: The flavonoids catechin, chrysoeriol, and taxifolin presented the best results according to the evaluation conducted in this study. These computational results can be used as a theoretical basis for future studies concerning the development of drug candidates, as well as to enlighten biological tests in vitro and in vivo, which can contribute to the treatment of neurodegenerative diseases, such as Alzheimer's disease, Parkinson's disease, and Huntington's disease.


Asunto(s)
Euterpe , Antioxidantes , Flavonoides/toxicidad , Humanos , Simulación del Acoplamiento Molecular , Polifenoles
SELECCIÓN DE REFERENCIAS
DETALLE DE LA BÚSQUEDA