Phytotherapeutic potential of Campomanesia xanthocarpa (Mart.) O. Berg: antitumor effects in vitro and in silico, with emphasis on SK-MEL-28 melanoma cells-a study on leaf and fruit infusions.

In silico pharmacology Pub Date : 2024-11-19 eCollection Date: 2024-01-01 DOI:10.1007/s40203-024-00286-1
Vanessa Ruana Ferreira da Silva, Gilnei Bruno da Silva, Daiane Manica, Carolina Turnes Pasini Deolindo, Margarete Dulce Bagatini, Aniela Pinto Kempka
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Abstract

The study investigated the efficacy of Campomanesia xanthocarpa infusions on human melanoma cells (SK-MEL-28). The phytochemical profile revealed 18 phenolic compounds in the leaf infusion and 9 in the fruit infusion. After 24 h of treatment, the infusions demonstrated antineoplastic effects, reducing cell viability at all tested concentrations for the leaf infusion. For the fruit infusion, a significant reduction in cell viability was observed specifically at the 800 μg/mL concentration. Fluorescence microscopy and mitochondrial membrane potential results indicated that the leaf infusion was more effective in reducing cell viability and mitochondrial function in SK-MEL-28 cells, possibly due to its greater variety of phenolic compounds compared to the fruit infusion. The leaf infusion also induced higher production of intracellular reactive oxygen species compared to the fruit infusion. Protein sulfhydryl levels were reduced for the leaf infusion. Epigallocatechin gallate, Isoquercitrin, Rutin, Kaempferol-3-O-rutinoside, Chlorogenic acid, and Ellagic acid were identified as the main compounds with activity against SK-MEL-28 cells. Molecular docking analysis underscored factors such as affinity, cavity size, binding mode, and contact residues with specific compounds chosen for their favorable properties in targeting BRAF, CDK4, CDK6, MEK1, and MEK2. The variability in binding affinities may directly influence the compounds' ability to inhibit different signaling pathways related to cancer cell growth and proliferation. The results suggest that phenolic compounds from C. xanthocarpa extracts have therapeutic potential and could contribute to melanoma therapies.

Supplementary information: The online version contains supplementary material available at 10.1007/s40203-024-00286-1.

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Campomanesia xanthocarpa (Mart.) O. Berg的植物治疗潜力:体外和体内抗肿瘤作用,重点是SK-MEL-28黑色素瘤细胞--关于叶片和果实注射液的研究。
该研究调查了Campomanesia xanthocarpa输液对人类黑色素瘤细胞(SK-MEL-28)的疗效。植物化学成分分析表明,叶浸泡液中含有 18 种酚类化合物,果浸泡液中含有 9 种酚类化合物。治疗 24 小时后,叶浸液显示出抗肿瘤作用,在所有测试浓度下都能降低细胞存活率。在果实浸液中,特别是在 800 微克/毫升的浓度下,细胞活力明显降低。荧光显微镜和线粒体膜电位结果表明,叶浸液在降低 SK-MEL-28 细胞活力和线粒体功能方面更有效,这可能是由于与果实浸液相比,叶浸液含有更多种类的酚类化合物。与果实浸泡液相比,叶片浸泡液还能诱导产生更多的细胞内活性氧。叶片浸泡液的蛋白质巯基水平降低。表没食子儿茶素没食子酸酯、异槲皮苷、芦丁、堪非醇-3-O-芸香糖苷、绿原酸和鞣花酸被确定为对 SK-MEL-28 细胞具有活性的主要化合物。分子对接分析强调了亲和力、空腔大小、结合模式和接触残基等因素,特定化合物因其在靶向 BRAF、CDK4、CDK6、MEK1 和 MEK2 方面的有利特性而被选中。 结合亲和力的差异可能会直接影响化合物抑制与癌细胞生长和增殖相关的不同信号通路的能力。研究结果表明,黄柏提取物中的酚类化合物具有治疗潜力,可为黑色素瘤疗法做出贡献:在线版本包含补充材料,可查阅 10.1007/s40203-024-00286-1。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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