新型双核se - n-杂环加合物的对接设计绿色合成及体外抗癌研究

M. Atif, M. Iqbal, Mansoureh Nazari
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引用次数: 0

摘要

采用分子对接方法设计了两种双核硒加合物(5和6),并发现它们与四种血管生成因子蛋白(包括COX-1(环氧化酶-1)、VEGF-A(血管内皮生长因子A)、HIF(缺氧诱导因子)和EGF(人表皮生长因子)有很好的相互作用。因此,采用原位配位法对它们进行了合成。采用绿色合成的方法进行配位,因为它是在水中而不是在有机溶剂中进行的。合成的加合物及其相应的双苯并咪唑盐(2和4)通过1h和13c - nmr以及FT-IR光谱进行了证实。然后,使用MTT法对这两种细胞进行体外抗乳腺癌腺癌细胞系(MCF-7)、宫颈癌细胞系(Hela)、小鼠黑色素瘤细胞系(B16F10)和视网膜神经节细胞系(RGC-5)的活性研究,并将其与商业标准药物5-氟尿嘧啶的活性进行比较。然而,研究了加合物和双苯并咪唑盐的特殊活性。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Docking-Designed Green Synthesis and In-Vitro Anticancer Studies of New Binuclear Se-N-Heterocyclic Carbene Adducts
Two binuclear selenium adducts ( 5 and 6 ) were designed using molecular docking approach while finding their promising interaction to four angiogenic factor-proteins including COX-1 (Cyclooxygenase-1), VEGF-A (vascular endothelial growth factor A), HIF (Hypoxia-inducible factor) and EGF (human epidermal growth factor). They were consequently synthesized using In-situ coordination approach. The green synthetic approach was employed for coordination as it was carried out in water instead of organic solvents. The synthesized adducts as well as their respective bis-benzimidazolium salts ( 2 and 4 ) were confirmed by 1 H and 13 C-NMR along with FT-IR spectroscopy. The both were, then, subjected to In-vitro anticancer activities against breast adenocarcinoma cell line (MCF-7), cervical cancer cell line (Hela), mouse melanoma cell line (B16F10) and retinal ganglion cell line (RGC-5) using MTT assay while comparing their activities with a commercially established standard-drug 5-Fluorouracil. However, the exceptional activities of both adducts and bis-benzimidazolium salts were explored.
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