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计算与体外方法阐明山金车在激素依赖性乳腺癌中的抗癌作用。

Computational and In Vitro Approaches to Elucidate the Anti-cancer Effects of Arnica montana in Hormone-Dependent Breast Cancer.

机构信息

Amity Institute of Molecular Medicine and Stem Cell Research, Amity University, Noida, Uttar Pradesh, India.

Amity Institute of Biotechnology, Amity University, Noida, Uttar Pradesh, India.

出版信息

Homeopathy. 2022 Nov;111(4):288-300. doi: 10.1055/s-0042-1743565. Epub 2022 Jul 5.

Abstract

BACKGROUND

Breast cancer is the most common cancer in women worldwide. Use of homeopathic medicines for the treatment of cancers has increased in the last several years. is an anti-inflammatory homeopathic medicine used in traumatic conditions and because of this property we performed investigations for its potential as a chemotherapeutic agent against breast cancer.

METHODS

An ethanolic extract of (mother tincture, MT), prepared according to the Homoeopathic Pharmacopoeia of India, was characterized by gas chromatography-mass spectroscopy (GC-MS), followed by computational () analysis using molecular docking, to identify specific compounds that can bind and modulate the activity of key proteins involved in breast cancer survival and progression. To validate the findings, in a controlled experiment breast cancer cells (MCF7) were treated with and the cytotoxic effects assessed by flowcytometry, fluorescence microscopy, scratch assay, clonogenic potential and gene expression analysis.

RESULTS

Phytochemical characterization of ethanolic extract of MT by GC-MS allowed identification of several compounds. Caryophyllene oxide and 7-hydroxycadalene were selected for molecular docking studies, based on their potential drug-like properties. These compounds displayed selective binding affinity to some of the recognized target proteins of breast cancer, which included estrogen receptor alpha (ERα), progesterone receptor (PR), epidermal growth factor receptor (EGFR), mTOR (mechanistic target of rapamycin) and E-cadherin. studies revealed induction of apoptosis in MCF7 cells following treatment with MT. Furthermore, treatment with MT revealed its ability to inhibit migration and colony forming abilities of the cancer cells.

CONCLUSION

Considering the apoptotic and anti-migratory effects of in breast cancer cells , there is a need for this medicine to be further validated in an model.

摘要

背景

乳腺癌是全球女性最常见的癌症。近年来,人们越来越多地使用顺势疗法药物治疗癌症。 是一种用于治疗创伤的抗炎顺势疗法药物,由于这种特性,我们研究了它作为乳腺癌化疗药物的潜力。

方法

根据印度顺势疗法药典,用乙醇制备 (母酊剂,MT)提取物,并用气相色谱-质谱联用(GC-MS)进行了表征,随后使用计算()分析进行了分子对接,以鉴定可以结合并调节与乳腺癌存活和进展相关的关键蛋白活性的特定化合物。为了验证 的发现,在对照实验中,用 处理乳腺癌细胞(MCF7),并通过流式细胞术、荧光显微镜、划痕实验、集落形成能力和基因表达分析评估细胞毒性作用。

结果

通过 GC-MS 对 MT 的乙醇提取物进行的植物化学表征允许鉴定出几种化合物。根据其潜在的药物特性,选择石竹烯氧化物和 7-羟基卡达烯进行分子对接研究。这些化合物显示出对乳腺癌某些公认靶蛋白(包括雌激素受体α(ERα)、孕激素受体(PR)、表皮生长因子受体(EGFR)、mTOR(雷帕霉素的机制靶标)和 E-钙粘蛋白)的选择性结合亲和力。 研究表明,用 MT 处理 MCF7 细胞后会诱导细胞凋亡。此外,用 MT 处理还显示出抑制癌细胞迁移和集落形成能力的能力。

结论

鉴于 在乳腺癌细胞中的凋亡和抗迁移作用,需要在 模型中进一步验证这种药物。

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