基于优势结构、天然活性物质、骨架跃迁、药物信息学等药物化学新技术的靶向化合物库研究;基于结构生物学、药物结构片段的药物发现、结构优化、构效关系研究;生物活性物质的作用机理研究。
近期研究论文:
- Meng, T.; Zou, Y.; Khorev, O.; Jin, Y.; Zhou, H.; Zhang, Y.; Hu, D.; Ma, L.; Wang, X.; Shen, J*. Simple and Efficient Copper(I)-Catalyzed Access to Three Versatile Aminocoumarin-Based Scaffolds using Isocyanoacetate. Adv Synth Catal 2011, 918-924.
- Mengzhu Xue, Mingyue Zheng, Bing Xiong,* Yanlian Li, Hualiang Jiang, and Jingkang Shen*Knowledge-Based Scoring Functions in Drug Design. 1. Developing a Target-Specific Method for Kinase-Ligand Interactions. J. Chem. Inf. Model. 2010,50, 1378–1386;
- LING Qing, ZHOU Yue-yang, CAI Zheng-liang, ZHANGYa-hui, XIONG Bing, MA Lan-ping,WANG Xin, LI Xin, LI Jia, SHEN Jing-kang*. Synthesis and LAR inhibition of 7-alkoxy analogues of illudalic acid. Acta Pharmaceutica Sinica 2010, 45 (11),1385-1397;
- Bing Xiong*, Jie Wu, David L Burk, Mengzhu Xue, Hualiang Jiang, Jingkang Shen*,BSSF: a fingerprint based ultrafast binding site similarity search and function analysis server,BMC Bioinformatics,2010, 11, 47-58;
- Tao Meng, Min Li, Yongliang Zhang, Guanghua Fang, Yu Jing, Xin Wang, Jingkang Shen*,Intramolecular Cyclization to Novel Substituted Benzimidazo[1,2-a]quinoxalin-6(5H)-ones Synthesis,J. Comb. Chem., 2010, 222-224;
- Yongli Du, Qunyi Li, Bing Xiong, Xin Hui, Xin Wang, Yang Feng, Tao Meng, Dingyu Hu, Datong Zhang, Mingwei Wang*, Jingkang Shen*, Aromaticβ-amino-ketone derivatives as novel selective non-steroidal progesterone receptor antagonists, Bioorg. Med. Chem., 2010, 18, 4255-4268;
- Tao Meng, Jue Wang, Hongli Peng*, Guanghua Fang, Min Lia, Bing Xiong, Xin Xie*, Xin Wang, Jingkang Shen*, Discovery of Benzhydrylpiperazine Derivatives as CB1 Receptor Inverse Agonists via Privileged Structure Based Approach, Eur. J. Med. Chem, 2010,45,1133-1139;
- Hong-xia GUO, Dai-hua LIU, Ying MA, Jin-feng LIU, Ying WANG, Zhi-yan DU, Xin WANG, Jing-kang SHEN, Hong-li PENG*,Long-term baicalin administration ameliorates metabolic disorders and hepatic steatosis in rats given a high-fat diet, Acta Pharmacol Sin, 2009 ; 30, 1505–1512;
- Bi-bo YAN, Meng-zhu XUE, Bing XIONG*, Ke LIU, Ding-yu HU, Jing-kang SHEN*, ScafBank: A Public Comprehensive Scaffold Database to Support Molecular Hopping, Acta Pharmacol Sin, 2009 ; 30(2),251-258;
- Yiping Zhu, Kun Xiao, Lanping Ma, Bin Xiong, Yan Fu, Haiping Yu, Wei Wang, Xin Wang, Dingyu Hu, Hongli Peng, Jingya Li, Qi Gong, Qian Chai, a Xican Tang, Haiyan Zhang*, Jia Li*, and Jingkang Shen*, Design, Synthesis and Biological Evaluation of Novel Dual Inhibitors of Acetylcholinesterase and β-Secretase, Bioorg. Med. Chem. 2009; 17, 1600-1613;
- Yi-ping ZHU, Kun XIAO, Hai-ping YU, Lan-ping MA, Bing XIONG, Haiyan ZHANG, Xin WANG, Jing-ya LI, Jia LI*, Jing-kang SHEN*, Discovery of potent β-secretase (bace-1) inhibitors by the synthesis of isophthalamide-containing hybrids, Acta Pharmacol Sin, 2009 ; 30 (2) , 250-270;
- Bing Xiong, Ke Liu, Jie Wu, David L. Burk, Albert M. Berghuis, Hualiang Jiang,Jingkang Shen*, DrugViz: a Cytoscape plug-in for visualizing and analyzing small molecule drugs in networks, Bioinformatics, 2008, 24, 2117-2118;
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