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Active constituents and mechanisms of Respiratory Detox Shot, a traditional Chinese medicine prescription, for COVID-19 control and prevention: Network -molecular docking-LC-MSE analysis 期刊论文
JOURNAL OF INTEGRATIVE MEDICINE-JIM, 2020, 卷号: 18, 期号: 3, 页码: 229-241
作者:  Zhang, Zi-jia;  Wu, Wen-yong;  Hou, Jin-jun;  Zhang, Lin-lin;  Li, Fei-fei
收藏  |  浏览/下载:49/0  |  提交时间:2020/07/01
Discovery of New and Potent InhA Inhibitors as Antituberculosis Agents: Structure-Based Virtual Screening Validated by Biological Assays and X-ray Crystallography 期刊论文
JOURNAL OF CHEMICAL INFORMATION AND MODELING, 2020, 卷号: 60, 期号: 1, 页码: 226-234
作者:  Kamsri, Pharit;  Hanwarinroj, Chayanin;  Phusi, Naruedon;  Pornprom, Thimpika;  Chayajarus, Kampanart
收藏  |  浏览/下载:23/0  |  提交时间:2020/07/01
Synthesis, molecular properties prediction and biological evaluation of indole-vinyl sulfone derivatives as novel tubulin polymerization inhibitors targeting the colchicine binding site 期刊论文
Bioorganic Chemistry, 2019, 卷号: Vol.85, 页码: 49-59
作者:  Wenlong Li;  Honghao Sun;  Feijie Xu;  Wen Shuai;  Jie Liu
收藏  |  浏览/下载:30/0  |  提交时间:2019/12/13
Synthesis, Molecular Properties Prediction and Biological Evaluation of Indole-Vinyl Sulfone Derivatives as Novel Tubulin Polymerization Inhibitors Targeting the Colchicine Binding Site 期刊论文
Bioorganic Chemistry, 2018
作者:  Wenlong Li;  Honghao Sun;  Feijie Xu;  Wen Shuai;  Jie Liu
收藏  |  浏览/下载:3/0  |  提交时间:2019/12/26
ADMETlab: a platform for systematic ADMET evaluation based on a comprehensively collected ADMET database 期刊论文
Journal of Cheminformatics, 2018, 卷号: 10, 期号: 1, 页码: 29
作者:  Dong, Jie;  Wang, Ning-Ning;  Yao, Zhi-Jiang;  Zhang, Lin;  Cheng, Yan
收藏  |  浏览/下载:9/0  |  提交时间:2019/12/28
Structure-Guided Discovery of Novel, Potent, and Orally Bioavailable Inhibitors of Lipoprotein-Associated Phospholipase A2 期刊论文
JOURNAL OF MEDICINAL CHEMISTRY, 2017, 卷号: 60, 期号: 24, 页码: 10231-10244
作者:  Liu, Qiufeng;  Huang, Fubao;  Yuan, Xiaojing;  Wang, Kai;  Zou, Yi
收藏  |  浏览/下载:32/0  |  提交时间:2019/01/08
Machine-Learning-Assisted Approach for Discovering Novel Inhibitors Targeting Bromodomain-Containing Protein 4 期刊论文
JOURNAL OF CHEMICAL INFORMATION AND MODELING, 2017, 卷号: 57, 期号: 7, 页码: 1677-1690
作者:  Xing, Jing;  Lu, Wenchao;  Liu, Rongfeng;  Wang, Yulan;  Xie, Yiqian
收藏  |  浏览/下载:23/0  |  提交时间:2019/01/08
Design, synthesis and anti-HIV-1 RT evaluation of 2-(benzyl(4-chlorophenyl)amino)-1-(piperazin-1-yl)ethanone derivatives 期刊论文
Bioorganic & Medicinal Chemistry Letters, 2017, 卷号: 27, 期号: 1, 页码: 61-65
作者:  Chander S;  Pang W;  Sankaranarayanan M[*];  Ashok P;  Yang LM
收藏  |  浏览/下载:26/0  |  提交时间:2016/12/01
Exploring the pharmacological mechanism of Yanghe Decoction on HER2-positive breast cancer by a network pharmacology approach 期刊论文
Journal of Ethnopharmacology, 2017, 卷号: 199, 页码: 68-85
作者:  Zeng, Luting*;  Yang, Kailin
收藏  |  浏览/下载:4/0  |  提交时间:2019/12/27
ER  estrogen receptor  PGR  progesterone receptor  HER  human epidermal growth factor receptor  CAM  complementary and alternative medicine  TCM  traditional Chinese medicine  YHD  Yanghe Decoction  OB  oral bioavailability  DL  drug-likeness  PPI  protein-protein interaction  GO  Gene Ontology  IGFR  insulin-like growth factor receptor  HB-EGF  heparin-binding growth factor  EGFR  epidermal growth factor receptor  PRE  progesterone response element  TGF  transforming growth factor  HDAC  histone deacetylase  CDK  cyclin dependent kinases  EMT  epithelial-mesenchymal transition  IGFBP  IGF-binding protein  FGFR  fibroblast growth factor receptor  Yanghe Decoction  HER2-positive breast cancer  Network pharmacology  Traditional Chinese medicine  Chinese medicine formulae  
Drug-symptom networking: Linking drug-likeness screening to drug discovery 期刊论文
PHARMACOLOGICAL RESEARCH, 2016, 卷号: 103, 页码: 105-113
作者:  Xu Xue;  Zhang Chao;  Li PiDong;  Zhang FeiLong;  Gao Kuo
收藏  |  浏览/下载:3/0  |  提交时间:2019/12/09


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