| Discovery of 4-((7H-Pyrrolo[2,3-d]pyrimidin-4-yl)amino)-N-(4-((4-methylpiperazin-1-yl)methyl)phenyl)-1H-pyrazole-3-carboxamide (FN-1501), an FLT3- and CDK … Y Wang, Y Zhi, Q Jin, S Lu, G Lin, H Yuan, T Yang, Z Wang, C Yao, J Ling, ... Journal of Medicinal Chemistry 61 (4), 1499-1518, 2018 | 83 | 2018 |
| Improved prediction of aqueous solubility of novel compounds by going deeper with deep learning Q Cui, S Lu, B Ni, X Zeng, Y Tan, YD Chen, H Zhao Frontiers in oncology 10, 121, 2020 | 77 | 2020 |
| FLT3 inhibitors in acute myeloid leukemia: challenges and recent developments in overcoming resistance Z Wang, J Cai, J Cheng, W Yang, Y Zhu, H Li, T Lu, Y Chen, S Lu Journal of Medicinal Chemistry 64 (6), 2878-2900, 2021 | 61 | 2021 |
| Bi-allelic mutations of DNAH10 cause primary male infertility with asthenoteratozoospermia in humans and mice C Tu, J Cong, Q Zhang, X He, R Zheng, X Yang, Y Gao, H Wu, M Lv, Y Gu, ... The American Journal of Human Genetics 108 (8), 1466-1477, 2021 | 54 | 2021 |
| An integrated virtual screening approach for VEGFR-2 inhibitors Y Zhang, S Yang, Y Jiao, H Liu, H Yuan, S Lu, T Ran, S Yao, Z Ke, J Xu, ... Journal of chemical information and modeling 53 (12), 3163-3177, 2013 | 52 | 2013 |
| Pharmacophore modeling and virtual screening studies to identify new c-Met inhibitors W Tai, T Lu, H Yuan, F Wang, H Liu, S Lu, Y Leng, W Zhang, Y Jiang, ... Journal of Molecular Modeling 18, 3087-3100, 2012 | 42 | 2012 |
| Norisoboldine, an alkaloid compound isolated from Radix Linderae, inhibits synovial angiogenesis in adjuvant-induced arthritis rats by moderating Notch1 pathway-related … Q Lu, S Lu, X Gao, Y Luo, B Tong, Z Wei, T Lu, Y Xia, G Chou, Z Wang, ... Experimental Biology and Medicine 237 (8), 919-932, 2012 | 35 | 2012 |
| A combined drug discovery strategy based on machine learning and molecular docking Y Zhang, Y Wang, W Zhou, Y Fan, J Zhao, L Zhu, S Lu, T Lu, Y Chen, ... Chemical Biology & Drug Design 93 (5), 685-699, 2019 | 25 | 2019 |
| Discovery of the selective and efficacious inhibitors of FLT3 mutations Y Zhi, B Li, C Yao, H Li, P Chen, J Bao, T Qin, Y Wang, T Lu, S Lu European journal of medicinal chemistry 155, 303-315, 2018 | 25 | 2018 |
| Identification of covalent binding sites targeting cysteines based on computational approaches Y Zhang, D Zhang, H Tian, Y Jiao, Z Shi, T Ran, H Liu, S Lu, A Xu, X Qiao, ... Molecular Pharmaceutics 13 (9), 3106-3118, 2016 | 25 | 2016 |
| Tivantinib (ARQ 197) affects the apoptotic and proliferative machinery downstream of c-MET: role of Mcl-1, Bcl-xl and Cyclin B1 S Lu, HP Török, E Gallmeier, FT Kolligs, A Rizzani, S Arena, B Göke, ... Oncotarget 6 (26), 22167, 2015 | 25 | 2015 |
| Insight into the key interactions of bromodomain inhibitors based on molecular docking, interaction fingerprinting, molecular dynamics and binding free energy calculation T Ran, Z Zhang, K Liu, Y Lu, H Li, J Xu, X Xiong, Y Zhang, A Xu, S Lu, ... Molecular bioSystems 11 (5), 1295-1304, 2015 | 25 | 2015 |
| Structure-based and shape-complemented pharmacophore modeling for the discovery of novel checkpoint kinase 1 inhibitors XM Chen, T Lu, S Lu, HF Li, HL Yuan, T Ran, HC Liu, YD Chen Journal of molecular modeling 16, 1195-1204, 2010 | 25 | 2010 |
| Combined pharmacophore modeling, docking, and 3D-QSAR studies of PLK1 inhibitors S Lu, HC Liu, YD Chen, HL Yuan, SL Sun, YP Gao, P Yang, L Zhang, T Lu International journal of molecular sciences 12 (12), 8713-8739, 2011 | 24 | 2011 |
| Investigation on the isoform selectivity of histone deacetylase inhibitors using chemical feature based pharmacophore and docking approaches Y Zhu, HF Li, S Lu, YX Zheng, Z Wu, WF Tang, X Zhou, T Lu European journal of medicinal chemistry 45 (5), 1777-1791, 2010 | 24 | 2010 |
| De novo design of N-(pyridin-4-ylmethyl)aniline derivatives as KDR inhibitors: 3D-QSAR, molecular fragment replacement, protein-ligand interaction fingerprint … Y Zhang, H Liu, Y Jiao, H Yuan, F Wang, S Lu, S Yao, Z Ke, W Tai, ... Molecular diversity 16, 787-802, 2012 | 22 | 2012 |
| Novel strategy for three-dimensional fragment-based lead discovery H Yuan, T Lu, T Ran, H Liu, S Lu, W Tai, Y Leng, W Zhang, J Wang, ... Journal of chemical information and modeling 51 (4), 959-974, 2011 | 19 | 2011 |
| Bi-allelic variants in human WDR63 cause male infertility via abnormal inner dynein arms assembly S Lu, Y Gu, Y Wu, S Yang, C Li, L Meng, W Yuan, T Jiang, X Zhang, Y Li, ... Cell Discovery 7 (1), 110, 2021 | 18 | 2021 |
| A selectivity study of sodium‐dependent glucose cotransporter 2/sodium‐dependent glucose cotransporter 1 inhibitors by molecular modeling J Xu, H Yuan, T Ran, Y Zhang, H Liu, S Lu, X Xiong, A Xu, Y Jiang, T Lu, ... Journal of Molecular Recognition 28 (8), 467-479, 2015 | 18 | 2015 |
| An efficient multistep ligand-based virtual screening approach for GPR40 agonists S Yao, T Lu, Z Zhou, H Liu, H Yuan, T Ran, S Lu, Y Zhang, Z Ke, J Xu, ... Molecular diversity 18, 183-193, 2014 | 15 | 2014 |
