新型喹啉基苯并噻唑基氨基酸棒状化合物的抗癌活性及其硅晶化研究

IF 2.2 4区 化学 Q3 CHEMISTRY, MULTIDISCIPLINARY Journal of the Iranian Chemical Society Pub Date : 2024-12-12 DOI:10.1007/s13738-024-03144-1
S. Shashidhar Bharadwaj, Boja Poojary, Sathish Kumar Boda, T. Shubhavathi, Vinuta Kamat, Bhuvanesh Sukhlal Kalal
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引用次数: 0

摘要

自从癌症成为一个更严重的问题以来,许多研究都集中在创造新的化疗药物上。在本研究中,我们开发了一些与氨基酸连接的喹啉基苯并噻唑,并评价了它们对黑色素瘤和乳腺癌细胞的抗癌作用。所有化合物都被评估为针对靶蛋白人雌激素受体(PDB: 2IOK)的计算机研究。在所有被评估的氨基酸偶联物中,有4个化合物5b、5k、5f和5d表现出显著的对接分数,并被选择用于体外抗癌研究。其中5k和5f对黑色素瘤细胞系的IC50[μg/mL]分别为22.9和22.3,5b对乳腺癌细胞的IC50[μg/mL]为61.0,表现出良好的抗癌性能。图形抽象
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Anticancer activity of new quinolinyl–benzothiazolyl clubbed with amino acids and their in-silico studies

A lot of research is focused on creating novel chemotherapeutic medicines since cancer is becoming a more serious concern. In the present investigation, we have developed some quinolinyl–benzothiazolyl linked with amino acids and their anticancer efficacy against melanoma and breast cancer cells evaluated. All the compounds evaluated for in silico studies towards the target protein Human estrogen receptor (PDB: 2IOK). Out of all the evaluated aminoacids conjugates four compounds 5b, 5 k, 5f, and 5d exhibited remarkable docking scores and were chosen for in vitro anticancer studies. Out of which 5 k, and 5f exhibited good anticancer properties with the IC50[μg/mL] of 22.9 and 22.3 respectively against the melanoma cell line and 5b exhibited good anticancer properties with the IC50[μg/mL] of 61.0 against breast cancer cell.

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来源期刊
CiteScore
4.40
自引率
8.30%
发文量
230
审稿时长
5.6 months
期刊介绍: JICS is an international journal covering general fields of chemistry. JICS welcomes high quality original papers in English dealing with experimental, theoretical and applied research related to all branches of chemistry. These include the fields of analytical, inorganic, organic and physical chemistry as well as the chemical biology area. Review articles discussing specific areas of chemistry of current chemical or biological importance are also published. JICS ensures visibility of your research results to a worldwide audience in science. You are kindly invited to submit your manuscript to the Editor-in-Chief or Regional Editor. All contributions in the form of original papers or short communications will be peer reviewed and published free of charge after acceptance.
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