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新型嘧啶衍生物作为潜在抗癌剂：合成、生物学评价及分子对接研究

Novel Pyrimidine Derivatives as Potential Anticancer Agents: Synthesis, Biological Evaluation and Molecular Docking Study.

作者信息

Tylińska Beata, Wiatrak Benita, Czyżnikowska Żaneta, Cieśla-Niechwiadowicz Aneta, Gębarowska Elżbieta, Janicka-Kłos Anna

机构信息

Department of Organic Chemistry, Wroclaw Medical University, Borowska 211A, 50-556 Wroclaw, Poland.

epartment of Pharmacology, Wroclaw Medical University, Mikulicza-Radeckiego 2, 50-345 Wrocław, Poland.

出版信息

Int J Mol Sci. 2021 Apr 7;22(8):3825. doi: 10.3390/ijms22083825.

DOI:10.3390/ijms22083825
PMID:33917090
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC8067809/
Abstract

In the present paper, new pyrimidine derivatives were designed, synthesized and analyzed in terms of their anticancer properties. The tested compounds were evaluated in vitro for their antitumor activity. The cytotoxic effect on normal human dermal fibroblasts (NHDF) was also determined. According to the results, all the tested compounds exhibited inhibitory activity on the proliferation of all lines of cancer cells (colon adenocarcinoma (LoVo), resistant colon adenocarcinoma (LoVo/DX), breast cancer (MCF-7), lung cancer (A549), cervical cancer (HeLa), human leukemic lymphoblasts (CCRF-CEM) and human monocytic (THP-1)). In particular, their feature stronger influence on the activity of P-glycoprotein of cell cultures resistant to doxorubicin than doxorubicin. Tested compounds have more lipophilic character than doxorubicin, which determines their affinity for the molecular target and passive transport through biological membranes. Moreover, the inhibitory potential against topoisomerase II and DNA intercalating properties of synthesized compounds were analyzed via molecular docking.

摘要

在本论文中，设计、合成了新型嘧啶衍生物，并对其抗癌特性进行了分析。对测试的化合物进行了体外抗肿瘤活性评估。还测定了其对正常人皮肤成纤维细胞（NHDF）的细胞毒性作用。根据结果，所有测试化合物均对所有癌细胞系（结肠腺癌（LoVo）、耐多柔比星结肠腺癌（LoVo/DX）、乳腺癌（MCF-7）、肺癌（A549）、宫颈癌（HeLa）、人白血病淋巴母细胞（CCRF-CEM）和人单核细胞（THP-1））的增殖表现出抑制活性。特别是，它们对耐多柔比星细胞培养物中P-糖蛋白活性的影响比多柔比星更强。测试化合物比多柔比星具有更强的亲脂性，这决定了它们对分子靶点的亲和力以及通过生物膜的被动转运。此外，通过分子对接分析了合成化合物对拓扑异构酶II的抑制潜力和DNA嵌入特性。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e558/8067809/7ee1bc3bd165/ijms-22-03825-g008.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e558/8067809/090e6da9928a/ijms-22-03825-sch001.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e558/8067809/234e56b4a34a/ijms-22-03825-g001.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e558/8067809/f2fe6e57724c/ijms-22-03825-g002.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e558/8067809/c27ad49a4201/ijms-22-03825-g003.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e558/8067809/62b152643335/ijms-22-03825-g004.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e558/8067809/2df1cf08ca87/ijms-22-03825-g005.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e558/8067809/afe4733d330e/ijms-22-03825-g006.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e558/8067809/afaa30d3cad3/ijms-22-03825-g007.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e558/8067809/7ee1bc3bd165/ijms-22-03825-g008.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e558/8067809/090e6da9928a/ijms-22-03825-sch001.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e558/8067809/234e56b4a34a/ijms-22-03825-g001.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e558/8067809/f2fe6e57724c/ijms-22-03825-g002.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e558/8067809/c27ad49a4201/ijms-22-03825-g003.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e558/8067809/62b152643335/ijms-22-03825-g004.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e558/8067809/2df1cf08ca87/ijms-22-03825-g005.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e558/8067809/afe4733d330e/ijms-22-03825-g006.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e558/8067809/afaa30d3cad3/ijms-22-03825-g007.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e558/8067809/7ee1bc3bd165/ijms-22-03825-g008.jpg

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2
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4
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