计算机辅助药物设计 牛彦,北京药学院药物化学系

理学博士，副教授，硕士生导师

办公电话: +86-10-82805281 电子邮箱: yanniu@bjmu.edu.cn

学习经历

2015.9-2016.9 德国康斯坦茨大学化学生物学与药理学系    访问学者

2013.8- 今      北京大学药学院   药物化学系     副教授，硕士生导师;

2007.8-2013.7 北京大学药学院   药物化学系      讲师;

2002.9-2007.7 北京大学药学院   化学生物学专业   博士;

1998.9-2002.7 北京大学药学院    药学专业       本科。

讲授课程

《药物化学》、《药物化学进展》、《计算机辅助药物设计》。

研究方向与兴趣

1.  药物先导化合物的发现和优化；

2.  基于靶标结构的药物分子设计与化学合成；

3.  活性小分子构效关系研究

获得奖励

1. 2019年，北京大学绿叶生物医药杰出青年学者奖；

2. 2017年，北京大学第17届青年教师教学基本功比赛(医科类)，优秀奖

3. 2010年，北京大学优秀班主任，二等奖

4. 2010年，北京大学药学院，优秀共产党员

5. 2009年，北京大学医学部，优秀教师奖

6. 2008年， 药学院第八届青年教师教学演示竞赛， 二等奖

代表性论文

1. Xiaona Li, Zirui Lü, Cong Wang, Kebin Li,  Fengrong Xu, Ping Xu*, and Yan Niu*, Induction of Apoptosis in Cancer Cells by Glutathione Transferase Inhibitor Mediated Hydrophobic Tagging Molecules, ACS Med Chem Lett, 2021, https://doi.org/10.1021/acsmedchemlett.0c00627

2. Zirui Lü, Xiaona Li, Kebin Li, Cong Wang, Tingting Du, Wei Huang, Ming Ji, Changhong Li, Fengrong Xu, Ping Xu*, and Yan Niu*，Structure–Activity Study of Nitazoxanide Derivatives as Novel STAT3 Pathway Inhibitors, ACS Med Chem Lett, 2021, https://doi.org/10.1021/acsmedchemlett.0c00544.

3. Sun Q, Zhou T, Xi D, Li X, Lü Z, Xu F, Wang C, Niu Y*, Xu P.*，Design and synthesis of tripeptidyl furylketones as selective inhibitors against the β5 subunit of human 20S proteasome. Eur J Med Chem. 2020,192: 112160. https://doi.org/10.1016/j.ejmech.2020.112160

4. P. Ripani, J. Delp, K. Bode, M. E. Delgado, L. Dietrich, V. M. Betzler, N. Yan, G. von Scheven, T. U. Mayer, M. Leist & T. Brunner*, Thiazolides promote G1 cell cycle arrest in colorectal cancer cells by targeting the mitochondrial respiratory chain, Oncogene, 2020, 39: 2345–2357.

5. Dandan Xi, Yan Niu*, Hongyue Li, Stefan M. Noha, Veronika Temml, Daniela Schuster*, Chao Wang, Fengrong Xu, and Ping Xu*, Discovery of carbazole derivatives as novel allosteric MEK inhibitors by pharmacophore modeling and virtual screening, Eur J Med Chem, 2019, 178: 802-817, https://doi.org/10.1016/j.ejmech.2019.06.027

6. Xiufeng Xu, Peng Lü, Junjie Wang, Fengrong Xu, Lei Liang, Chao Wang, Yan Niu*, and Ping Xu*, Design, synthesis, and biological evaluation of 4-aminopyrimidine or 4,6-diaminopyrimidine derivatives as beta amyloid cleaving enzyme-1 inhibitors, Chem. Biol. Drug Des., 2019, 93(5): 926-933. doi: 10.1111/cbdd.13489.

7. Gang Yan, Lina Hao, Yan Niu*, Wenjie Huang, Wei Wang, Fengrong Xu, Lei Liang, Chao Wang, Hongwei Jin, Ping Xu*, 2-Substituted-thio-N-(4-substituted-thiazol/1H-imidazol-2-yl)acetamides as BACE1 inhibitors: Synthesis, biological evaluation and docking studies, European Journal of Medicinal Chemistry , 2017, 137: 462–475

8. Jing Sun, Yan Niu*, Chao Wang, Hao Zhang, Bingyu Xie, Fengrong Xu, Hongwei Jin, Yihong Peng, Lei Liang, Ping Xu*, Discovery of 3-benzyl-1,3-benzoxazine-2,4-dione analogues as allosteric mitogen-activated kinase kinase (MEK) inhibitors and anti-enterovirus 71 (EV71) agents, Bioorganic & Medicinal Chemistry , 2016, 24: 3472–3482

9. Qi Sun, Bo Xu, Yan Niu*, Fengrong Xu, Lei Liang, Chao Wang, Jiapei Yu, Gang Yan, Wei Wang, Hongwei Jin*, Ping Xu*. Synthesis, Bioactivity, Docking and Molecular Dynamics Studies of Furan-Based Peptides as 20S Proteasome Inhibitors. ChemMedChem , 2015, 10, 498–510.

10. Peng Liu, Yan Niu,* Chao Wang, Qi Sun, Yaya Zhai, Jiapei Yu,Jing Sun, Fengrong Xu, Gang Yan, Wenjie Huang, Lei Liang, Ping Xu*, 4-Oxo-1,4-dihydroquinoline-3-carboxamides as BACE-1 inhibitors: synthesis, biological evaluation and docking studies,  European Journal of Medicinal Chemistry.  2014, 79: 413- 421.

11. Chao Wang, Hao Zhang, Fengrong Xu, Yan Niu*, Yun Wu, Xin Wang, Yihong Peng,Jing Sun, Lei Liang and Ping Xu* , Substituted 3-Benzylcoumarins as Allosteric MEK1 Inhibitors: Design, Synthesis and Biological Evaluation as Antiviral Agents,  Molecules , 2013, 18, 6057-6091.

12. Yan Niu, Haifei Gao, Fengrong Xu, Lei Liang, Peng Liu, Chao Wang, Guanyu Yang, Qi Sun, Ping Xu*, Design, synthesis and in vitro biological evaluation of 3-styrylbenzimidamides as potential BACE1 inhibitors,  Letters in Drug Design & Discovery , 2013, 10 ( 4 ): 297-302.

13. Yan Niu, Haifei Gao, Fengrong Xu, Chao Wang, Peng Liu, Guanyu Yang, Qi Sun, Ping Xu*, Synthesis, in vitro biological evaluation and molecular docking studies of benzimidamides as potential BACE1 inhibitors,  Chem Biol Drug Des , 2012, 80: 775–780.

14. Yan Niu, Chao Ma, Hongwei Jin, Fengrong Xu, Haifei Gao, Peng Liu, Yongjian Li, Chao Wang, Guanyu Yang and Ping Xu*, The Discovery of Novel b-Secretase Inhibitors: Pharmacophore Modeling, Virtual Screening, and Docking Studies,  Chem Biol Drug Des , 2012, 79:972-80.

15. Dong Wang, Liguo Yang, Jingjing Su, Yan Niu, Xiaoping Lei, Juan Xiong, Xiaohua Cao, Yinghe Hu, Bing Mei, Jin-Feng Hu, Attenuation of neurodegenerative phenotypes in Alzheimer-like presenilin1/presenilin 2 conditional double knockout mice by EUK1001, a promising derivative of xanomeline,  Biochemical and Biophysical Research Communications , 2011, 410: 229–234.

16. Yan Niu, Yuehua Wang, Xiaomin Zou, Xiaoming Yang, Chao Ma, Yang Lü, Bo Zhou, Yue Yuan, Guanhua Du and Ping Xu*. Synthesis and preliminary evaluation of peptidomimetic inhibitors of human β-secretase.  European Journal of Medicinal Chemistry.  2010, 45: 2089–2094.

17. Bo Zhou, Yan Niu, Xiao-Min Zou, Feng-Rong Xu, Yue Yuan, Chao Wang, Hai-Fei Gao, Peng Liu, Ping Xu*, Structure-based design of hexahydropyrimidin-5-ols as novel non-peptidic β-secretase inhibitors,  Journal of Chinese Pharmaceutical Sciences , 2010, 19 (5): 391-400.

18. Wen Si, Xuliang Zhang, Yan Niu, Huiting Yu, Xiaoping Lei, Huanxin Chen, Xiaohua Cao, A novel derivative of xanomeline improves fear cognition in aged mice,  Neuroscience Letters , 2010, 473: 115–119.

Yihui Cui, Dong Wang, Wen Si, Wen Lu, Yan Niu, Xiaoping Lei, Yinhe Hu, Xiaohua Cao*, Enhancement of memory function in aged mice by a novel derivative of xanomeline,  Cell Research , 2008: 1-3.

中国专利

(1) 徐萍，彭宜红，王超，牛彦，张浩，许凤荣，具有MEK抑制功能的化合物及其制备方法与应用，2015.11.18-2035.11.19，中国，CN201210440137.X

(2) 徐萍，牛彦，高海飞，许凤荣，具有β-分泌酶抑制功能的化合物及其制备方法与应用，2013.4.3-2031.9.20，中国，CN201110279736.3