Discovery of inhibitors of the novel oncology target, Pin 1: A case study in structure guided fragment evolution

被引:0
|
作者
Ray, Stuart C. [1 ]
Baker, Lisa [2 ]
Davis, Ben [2 ]
Fromont, Christophe [1 ]
Matassova, Natalia [2 ]
Moore, Jon [3 ]
Murray, James [2 ]
Nunns, Claire [1 ]
Potter, Andrew [1 ]
Richardson, Christine [4 ]
Robertson, Alan [2 ]
Robinson, David [2 ]
Simmonite, Heather [2 ]
Surgenor, Allan [2 ]
机构
[1] Vernalis, Chem, Cambridge CB21 6GB, England
[2] Vernalis, Struct Sci, Cambridge CB21 6GB, England
[3] Vernalis, Oncol, Cambridge CB21 6GB, England
[4] Vernalis, Computat Chem, Cambridge CB21 6GB, England
关键词
D O I
暂无
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
61-MEDI
引用
收藏
页数:1
相关论文
共 50 条
  • [41] Structure-Guided Discovery of Novel, Potent, and Orally Bioavailable Inhibitors of Lipoprotein-Associated Phospholipase A2
    Liu, Qiufeng
    Huang, Fubao
    Yuan, Xiaojing
    Wang, Kai
    Zou, Yi
    Shen, Jianhua
    Xu, Yechun
    JOURNAL OF MEDICINAL CHEMISTRY, 2017, 60 (24) : 10231 - 10244
  • [42] Identifying novel JAK1 inhibitors by structure-based virtual screening: A case study of using drug discovery tools at mcule.com
    Kiss, Robert
    Szalai, Ferenc
    Sayeski, Peter P.
    Keseru, Gyoergy M.
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2012, 244
  • [43] Design and synthesis of indolylpyridone derivatives for use as CHK1 inhibitors: A case study in structure based drug discovery
    Fiumana, Andrea
    Bedford, Simon
    Borgognoni, Jenifer
    Drysdale, Martin
    Foloppe, Nicolas
    Jordan, Allan M.
    Massey, Andrew
    Stokes, Stephen
    Web, Paul
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2010, 239
  • [44] Discovery of novel class 1 phosphatidylinositide 3-kinases (PI3K) fragment inhibitors through structure-based virtual screening
    Giordanetto, Fabrizio
    Kull, Bengt
    Dellsen, Anita
    BIOORGANIC & MEDICINAL CHEMISTRY LETTERS, 2011, 21 (02) : 829 - 835
  • [45] Structure-Guided Discovery and Preclinical Assessment of Novel (Thiophen-3-yl)aminopyrimidine Derivatives as Potent ERK1/2 Inhibitors
    Shuai, Wen
    Xiao, Huan
    Yang, Panpan
    Zhang, Yiwen
    Bu, Faqian
    Wu, Yongya
    Sun, Qiu
    Wang, Guan
    Ouyang, Liang
    JOURNAL OF MEDICINAL CHEMISTRY, 2024, 67 (08) : 6425 - 6455
  • [46] Discovery of novel piperidine-substituted indolylarylsulfones as potent HIV NNRTIs via structure-guided scaffold morphing and fragment rearrangement
    Li, Xiao
    Gao, Ping
    Huang, Boshi
    Zhou, Zhongxia
    Yu, Zhao
    Yuan, Zheng
    Liu, Huiqing
    Pannecouque, Christophe
    Daelemans, Dirk
    De Clercq, Erik
    Zhan, Peng
    Liu, Xinyong
    EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, 2017, 126 : 190 - 201
  • [47] Discovery of Novel HPK1 Inhibitors Through Structure-Based Virtual Screening
    Ge, Huizhen
    Peng, Lizeng
    Sun, Zhou
    Liu, Huanxiang
    Shen, Yulin
    Yao, Xiaojun
    FRONTIERS IN PHARMACOLOGY, 2022, 13
  • [48] Structure-based virtual screening towards the discovery of novel FOXM1 inhibitors
    Xie, Zhuo-Song
    Zhou, Zi-Ying
    Sun, Lian-Qi
    Yi, Hong
    Xue, Si-Tu
    Li, Zhuo-Rong
    FUTURE MEDICINAL CHEMISTRY, 2022, 14 (04) : 207 - 219
  • [49] Structure-guided Development of Novel Benzothiophene Derivatives as PLK1-PBD Inhibitors
    Huang, Daowei
    Zhang, Jing
    Yang, Xiaocong
    Tan, Xiangduan
    Chai, Tingting
    Ma, Lindeng
    Zhao, Bingyang
    Chen, Ying
    Yang, Jixia
    Zhang, Yue
    LETTERS IN DRUG DESIGN & DISCOVERY, 2024, 21 (11) : 2163 - 2174
  • [50] Comparative omics analysis for novel target discovery in plant pathogens: A case study for Magnaporthe oryzae
    Luthfi, Muhammad
    Piapukiew, Jittra
    Pandey, Ras B.
    Sompornpisut, Pornthep
    PLANT PATHOLOGY, 2024, 73 (03) : 564 - 577