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用于抗癌活性的芳基肼和酰肼的合成、生物学评价及分子对接

Synthesis, biological evaluation and molecular docking of aryl hydrazines and hydrazides for anticancer activity.

作者信息

Gohil Vikrantsinh M, Agrawal Satyam K, Saxena Ajit K, Garg Divita, Gopimohan C, Bhutani Kamlesh K

机构信息

Department of Natural Products, National Institute of Pharmaceutical Education and Research Sector-67, SAS Nagar, Punjab 160 062, India.

出版信息

Indian J Exp Biol. 2010 Mar;48(3):265-8.

Abstract

Aryl hydrazine and hydrazide analogues were synthesized based on p-tolyl hydrazine, isolated as a breakdown product of a secondary metabolite from the mushroom, Agaricus bisporus, and tested to be highly active molecule than 5-fluorouracil in in vitro anticancer studies. The synthesized analogues were tested for anticancer activity using NCI protocol. Anolgues 12 and 15 emerged as molecules with significant in vitro anticancer activity. Molecular docking study revealed the binding orientations of aryl hydrazines and hydrazides analogues in the active sites of thymidylate synthase.

摘要

基于对甲苯基肼合成了芳基肼和酰肼类似物,对甲苯基肼是双孢蘑菇中一种次生代谢产物的分解产物,经分离得到,并且在体外抗癌研究中经测试是比5-氟尿嘧啶活性更高的分子。使用美国国立癌症研究所(NCI)的方案对合成的类似物进行了抗癌活性测试。类似物12和15表现出显著的体外抗癌活性。分子对接研究揭示了芳基肼和酰肼类似物在胸苷酸合成酶活性位点的结合方向。

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