Xiaoyun Wu

发表

Bisarylureas Based on 1H-Pyrazolo[3,4-d]pyrimidine Scaffold as Novel Pan-RAF Inhibitors with Potent Anti-Proliferative Activities: Structure-Based Design, Synthesis, Biological Evaluation and Molecular Modelling Studies

Guangfa Wang, Zhonghuang Li, Jiajie Zhang, 2017, Molecules.

Investigation on the binding mechanism of loratinib with the c-ros oncogene 1 (ROS1) receptor tyrosine kinase via molecular dynamics simulation and binding free energy calculations

Jiajie Zhang, Shanhe Wan, Yuanyuan Wang, 2018, Journal of biomolecular structure & dynamics.

Insight into binding mechanisms of EGFR allosteric inhibitors using molecular dynamics simulations and free energy calculations

Zhonghuang Li, Shanhe Wan, Xiaoyun Wu, 2019, Journal of biomolecular structure & dynamics.

3D-QSAR study on 2,3-dihydroimidazo[4,5]-pyridin-2-one derivatives with a meta substitution pattern as V600EBRAF inhibitors

Shuguang Wu, Zhonghuang Li, Jiajie Zhang, 2013, Medicinal Chemistry Research.

Comparative study on the intestinal absorption of three gastrodin analogues via the glucose transport pathway.

Jie Zhao, Xiaoyun Wu, Zheng Cai, 2021, European journal of pharmaceutical sciences : official journal of the European Federation for Pharmaceutical Sciences.

Design and synthesis of proteolysis targeting chimeras (PROTACs) as an EGFR degrader based on CO-1686.

Shuyi Wang, Zhonghuang Li, Jiajie Zhang, 2022, European journal of medicinal chemistry.

Thienopyrrole acetic acids as antagonists of the CRTH2 receptor.

M. McPherson, Christopher M. Harris, Xiaoyun Wu, 2011, Bioorganic & medicinal chemistry letters.

Gaining insight into crizotinib resistance mechanisms caused by L2026M and G2032R mutations in ROS1 via molecular dynamics simulations and free-energy calculations

Jiajie Zhang, Shanhe Wan, Yu Fu, 2017, Journal of Molecular Modeling.

Molecular mechanism study of EGFR allosteric inhibitors using molecular dynamics simulations and free energy calculations

Zhonghuang Li, Jiajie Zhang, Shanhe Wan, 2021, Journal of biomolecular structure & dynamics.

Design, synthesis and biological evaluations of 2-amino-4-(1-piperidine) pyridine derivatives as novel anti crizotinib-resistant ALK/ROS1 dual inhibitors.

Yuan-xin Tian, Zhonghuang Li, Jiajie Zhang, 2019, European journal of medicinal chemistry.

Design, synthesis, anti-tumor activity, and molecular modeling of quinazoline and pyrido[2,3-d]pyrimidine derivatives targeting epidermal growth factor receptor.

Guangfa Wang, Yuan-xin Tian, Zhonghuang Li, 2016, European journal of medicinal chemistry.

2,4-Diaminopyrimidine MK2 inhibitors. Part II: Structure-based inhibitor optimization.

Eric F. Johnson, R. Dixon, D. Borhani, 2010, Bioorganic & medicinal chemistry letters.

Design, synthesis, biological evaluation and molecular modeling of novel 1H-pyrazolo[3,4-d]pyrimidine derivatives as BRAFV600E and VEGFR-2 dual inhibitors.

Guangfa Wang, Zhonghuang Li, Jiajie Zhang, 2018, European journal of medicinal chemistry.

Anti-proliferative activity and structure-activity relationship of honokiol derivatives.

Xiaoyun Wu, Aiyu Chen, Junmei Peng, 2019, Bioorganic & medicinal chemistry.

Computational investigation on inhibition mechanism of BRAFV600E by Vemurafenib (PLX4032) and its analogue PLX4720

Jiajie Zhang, Shanhe Wan, Yu Fu, 2017, Medicinal Chemistry Research.

Design, synthesis, biological evaluation and molecular modeling of novel 2-amino-4-(1-phenylethoxy) pyridine derivatives as potential ROS1 inhibitors.

Guangfa Wang, Yuan-xin Tian, Zhonghuang Li, 2018, European journal of medicinal chemistry.

Identification of imidazo[4,5-c]pyridin-2-one derivatives as novel Src family kinase inhibitors against glioblastoma

Jiajie Zhang, Zichao Yang, Tingting Zhang, 2021, Journal of enzyme inhibition and medicinal chemistry.

3D-QSAR study on 2,3-dihydroimidazo[4,5]-pyridin-2-one derivatives with a meta substitution pattern as V600EBRAF inhibitors

Shuguang Wu, Zhonghuang Li, Jiajie Zhang, 2014, Medicinal Chemistry Research.

Molecular docking and 3D-QSAR study on 4-(1H-indazol-4-yl) phenylamino and aminopyrazolopyridine urea derivatives as kinase insert domain receptor (KDR) inhibitors

Shuguang Wu, Wen-Hua Chen, Xiaoyun Wu, 2012, Journal of Molecular Modeling.

Molecular dynamics simulation and free energy calculation studies of kinase inhibitors binding to active and inactive conformations of VEGFR-2.

Guangfa Wang, Yuan-xin Tian, Zhonghuang Li, 2015, Journal of molecular graphics & modelling.

Design, synthesis and biological evaluation of 2-amino-4-(1,2,4-triazol)pyridine derivatives as potent EGFR inhibitors to overcome TKI-resistance.

Jiajie Zhang, Zichao Yang, Tingting Zhang, 2019, European journal of medicinal chemistry.

Molecular dynamics simulation and free energy calculation studies of the binding mechanism of allosteric inhibitors with TrkA kinase

Jiajie Zhang, Shanhe Wan, Xiaoyun Wu, 2019, Journal of biomolecular structure & dynamics.

Three Dimensional Quantitative Structure-Activity Relationship of 5H-Pyrido[4,3-b]indol-4-carboxamide JAK2 Inhibitors

Jiajie Zhang, Shanhe Wan, Xiaoyun Wu, 2013, International journal of molecular sciences.