基于片段组合方法的新型蛋白激酶CK2抑制剂设计、合成及抗癌活性研究

81402852
2014
H3407.药物设计与药物信息
张娜
青年科学基金项目
副教授
北京工业大学
23万元
蛋白激酶CK2;整体性识别机制;片段组合;结构优化;抑制剂
2015-01-01到2017-12-31
  • 中英文摘要
  • 结题摘要
  • 结题报告
  • 项目成果
  • 项目参与人
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序号 标题 类型 作者
1 Structural basis for low-affinity binding of Non-R2 Carboxylate-substituted Tricyclic Quinoline analogs to CK2 alpha: Comparative molecular dynamics simulation studies 期刊论文 Zhou Yue;Li Xitao;Zhang Na;Zhong Rugang
2 基于药效片段组合的新型蛋白激酶CK2α抑制剂设计及其活性评价 会议论文 周玥;张娜
3 蛋白激酶抑制剂香豆素及其制备方法和医药应用 专利 张娜;周玥;陈文娟;钟儒刚
4 Underlying mechanisms of cyclic peptide inhibitors interrupting the interaction of CK2 alpha/CK2 beta: comparative molecular dynamics simulation studies 期刊论文 Zhou Yue;Zhang Na;Chen Wenjuan;Zhao Lijiao;Zhong Rugang
5 氟代 7-羟基香豆素类化合物在蛋白激酶抑制剂或/和抗肿瘤药物中的应用 专利 张娜;陈文娟;张凤娟;钟儒刚
6 Molecular modeling studies of strucuture and function prediction of CK2. 会议论文 Zhang Na;Li Jintao
7 Rational design of Coumarin derivatives as CK2 inhibitors by improving the interaction with the hinge region 期刊论文 Zhang Na;Chen Wenjuan;Zhou Yue;Zhao Hongtao;Zhong Rugang
8 3D-QSAR study of flavones as ck2 inhibitors by a combined computational modeling 期刊论文 Zhang Na;Chen wenjuan;Zhou Yue;Liu Yuankun;Zhao Lijiao;Zhong Rugang
9 Exploring the pivotal role of the CK2 hinge region Sub-pocket in binding with Tricyclic Quinolone analogues by computational cnalysis 期刊论文 Zhou Yue;Zhang Na;Tang Shan;Qi Xiaoqian;Zhao Lijiao;Zhong Rugang;Peng Yongzhen
10 香豆素类化合物清除自由基及抗肿瘤活性研究 期刊论文 张娜;陈文娟;柳青青;周玥;钟儒刚
11 Synthesis and biological evaluation of 7-hydroxycoumarins derivatives 会议论文 Zhang Na;Zhou Yue;Chen Wenjuan
12 Insights into the impact of linker flexibility and fragment ionization on the design of CK2 allosteric inhibitors: Comparative molecular dynamics simulation studies 期刊论文 Zhou Yue;Zhang Na;Qi Xiaoqian;Tang Shan;Sun Guohui;Zhao Lijiao;Zhong Rugang;Peng Yongzhen
13 Enriching screening libraries with bioactive fragment space 期刊论文 Zhang Na;Zhao Hongtao
14 Identification of novel CK2 inhibitors by pharmacophore-based virtual screening 会议论文 Tang Shan;Zhang Na;Zhou Yue
15 Synthesis and biological evaluation of 7-Hydroxycoumarins derivatives as novel CK2 inhibitors for anticancer therapy 期刊论文 Zhou Yue;Zhang Na;Chen Wenjuan;Liu Yuankun;Zhao Lijiao;Zhong Rugag
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