Programa de Pós-Graduação em Química, Universidade Federal do Ceará, Campus do Pici, 60021-940, Fortaleza, CE, Brazil.
Programa de Pós-Graduação em Ciências Naturais, Universidade Estadual de Ceará, Campus do Itaperi, 60714-242, Fortaleza, CE, Brazil.
Chem Biodivers. 2024 Nov;21(11):e202401207. doi: 10.1002/cbdv.202401207. Epub 2024 Oct 8.
Anxiety and epilepsy are common worldwide and represent a primary global health concern. Fisetin, a flavonoid isolated from Bauhinia pentandra, has a wide range of biological activities may be a promising alternative to combat diseases related to the central nervous system (CNS). The present study aimed to investigate the anxiolytic and anticonvulsant effects of fisetin on adult zebrafish. Furthermore, molecular docking simulations were performed to improve the results. Fisetin did not present toxicity and caused anxiolytic behavior and delayed seizures in animals. This effect may occur through serotonin neurotransmission at 5-HT and/or 5-HT receptors. Molecular docking simulations showed that fisetin interacts with the orthosteric site of the 5-HT receptor with strong H-bond interactions with the Trp156 residue, with a strong contribution from the catechol ring, a behavior similar to that of the antagonist co-crystallized inhibitor granisetron (CWB). Fisetin may be a promising alternative to combat diseases related to the central nervous system.
焦虑症和癫痫在全球范围内都很常见,是一个主要的全球健康关注点。根皮素是从羊蹄甲中分离出来的一种黄酮类化合物,具有广泛的生物活性,可能是对抗与中枢神经系统(CNS)相关疾病的有前途的选择。本研究旨在研究根皮素对成年斑马鱼的抗焦虑和抗惊厥作用。此外,还进行了分子对接模拟以提高结果。根皮素没有表现出毒性,并且在动物中引起了焦虑行为和延迟癫痫发作。这种作用可能是通过 5-HT 和/或 5-HT 受体的血清素神经传递发生的。分子对接模拟表明,根皮素与 5-HT 受体的正位点相互作用,与色氨酸 156 残基形成强氢键相互作用,儿茶酚环有很强的贡献,其行为类似于拮抗剂共结晶抑制剂格兰司琼(CWB)。根皮素可能是对抗与中枢神经系统相关疾病的有前途的选择。