植物提取的槲皮素与合成的比卡鲁胺对前列腺癌和正常细胞株的体外联合作用:硅学比较。

In silico pharmacology Pub Date : 2024-03-29 eCollection Date: 2024-01-01 DOI:10.1007/s40203-024-00192-6
Mary Shobha Rani Inala, Kiranmayee Pamidimukkala
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引用次数: 0

摘要

前列腺癌是男性第二大高发癌症,也是男性第五大死因。虽然除其他因素外,饮食也与癌症的发病率有关,但癌症与预防之间的关系并不密切。由于细胞的抗药性,治疗方案面临风险。为了确定新的组合,我们尝试在细胞系中使用植物提取的槲皮素和比卡鲁胺。为了确定植物萃取的槲皮素及其组合的细胞毒性和凋亡潜力,我们进行了 MTT [3-(4,5-dimethylthiazol-2-yl)-2,5 diphenyl tetrazolium bromide] 和双重染色试验。为支持体外实验结果,还进行了蛋白质-配体相互作用的硅学研究。使用薄层、色谱柱和高效色谱法纯化了槲皮素和真品样品。在细胞毒性研究中,与对照组相比,槲皮素的细胞毒性降低了 80%,与比卡鲁胺相似;与对照组相比,槲皮素和比卡鲁胺组合的细胞毒性降低了 50%,比对照组降低了 2%。槲皮素和比卡鲁胺对雄激素受体(9.7 和 9.8)、枢纽基因(10.8 和 10.0)以及其他一些 PCa 相关基因(9.4 和 9.1)的结合亲和力相似。我们建议,如果进行更多的体内研究,槲皮素和比卡鲁胺的组合可用于化疗。摄入多酚化合物含量高的食物有助于预防前列腺癌。槲皮素对几种细胞系的研究将为抗癌提供明确的结论。
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In vitro combination effects of plant-derived quercetin with synthetic bicalutamide on prostate cancer and normal cell lines: in silico comparison.

Prostate cancer is the second most frequent and the fifth greatest cause of death in men. Although diet has been connected to the prevalence of cancer in addition to other factors, the relation between cancer and prevention is weak. Treatment options are at risk due to cell resistance. To identify new combinations, we tried plant-derived quercetin with bicalutamide on cell lines. To determine the cytotoxicity and apoptotic potential of plant-derived quercetin and its combination, MTT [3-(4,5-dimethylthiazol-2-yl)-2,5 diphenyl tetrazolium bromide] and dual stain assays were performed. In silico protein-ligand interaction was performed to support the in vitro findings. A thin layer, column, and high-performance chromatography were used to purify quercetin along with an authentic sample. In the cytotoxic study, quercetin was minimized by 80% similar to bicalutamide and a combination of quercetin and bicalutamide by 50% when compared to controls by 2%. Quercetin and bicalutamide showed a similar binding affinity for androgen receptors (9.7 and 9.8), hub genes (10.8 and 10.0), and a few other PCa-related genes (9.4 and 9.1). We propose to conclude that the combination of quercetin plus bicalutamide can be used for chemotherapy if additional in vivo studies are conducted. The intake of foods high in polyphenolic compounds can help to prevent prostate cancer. Examination of quercetin on several cell lines will provide a definite conclusion to combat cancers.

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