A QSAR study on influenza neuraminidase inhibitors

被引:36
|
作者
Verma, RP [1 ]
Hansch, C [1 ]
机构
[1] Pomona Coll, Dept Chem, Claremont, CA 91711 USA
关键词
hydrophobicity; molar refractivity; molar volume; number of valence electrons; neuraminidase; QSAR;
D O I
10.1016/j.bmc.2005.09.016
中图分类号
Q5 [生物化学]; Q7 [分子生物学];
学科分类号
071010 ; 081704 ;
摘要
Influenza is a major respiratory infection associated with significant morbidity in the general population and mortality in elderly and high-risk patients. It is ail RNA virus that contains two major surface glycoproteins, neuraminidase and hemagglutinin. These proteins are essential for infection. Neuraminidase has been found to be a potential target to control influenza virus. In this paper, we have developed 17 quantitative structure-activity relationships (QSAR) for different sets of compounds to understand chemical-biological interactions governing their activities toward influenza neuraminidase. (c) 2005 Elsevier Ltd. All rights reserved.
引用
收藏
页码:982 / 996
页数:15
相关论文
共 50 条
  • [1] QSAR Studies on Influenza Neuraminidase Inhibitors——Acylthiourea Analogue
    景举华
    梁桂兆
    梅虎
    张巧霞
    李志良
    吕凤林
    [J]. Chinese Journal of Structural Chemistry, 2009, 28 (02) : 200 - 204
  • [2] QSAR Studies on Influenza Neuraminidase Inhibitors——Acylthiourea Analogue
    景举华
    梁桂兆
    梅虎
    张巧霞
    李志良
    吕凤林
    [J]. 结构化学, 2009, 28 (02) : 200 - 204
  • [3] QSAR Studies on Influenza Neuraminidase Inhibitors - Acylthiourea Analogue
    Jing Ju-Hua
    Liang Gui-Zhao
    Mei Hu
    Zhang Qiao-Xia
    Li Zhi-Liang
    Lv Feng-Lin
    [J]. CHINESE JOURNAL OF STRUCTURAL CHEMISTRY, 2009, 28 (02) : 200 - 204
  • [4] Study on molecular mechanism and 3D-QSAR of influenza neuraminidase inhibitors
    Yi, X
    Guo, ZR
    Chu, FM
    [J]. BIOORGANIC & MEDICINAL CHEMISTRY, 2003, 11 (07) : 1465 - 1474
  • [5] QSAR Studies on Neuraminidase Inhibitors as Anti-influenza Agents
    Veerasamy, Ravichandran
    Rajak, Harish
    [J]. TURKISH JOURNAL OF PHARMACEUTICAL SCIENCES, 2021, 18 (02) : 151 - 156
  • [6] Combine 3D-QSAR analysis of influenza neuraminidase inhibitors
    Wang, T
    Wade, RC
    [J]. RATIONAL APPROACHES TO DRUG DESIGN, 2001, : 78 - 82
  • [7] QSAR Study of H1N1 Neuraminidase Inhibitors from Influenza a Virus
    Worachartcheewan, Apilak
    Nantasenamat, Chanin
    Isarankura-Na-Ayudhya, Chartchalerm
    Prachayasittikul, Virapong
    [J]. LETTERS IN DRUG DESIGN & DISCOVERY, 2014, 11 (04) : 420 - 427
  • [8] Docking and 3D QSAR study of thiourea analogs as potent inhibitors of influenza virus neuraminidase
    Jiaying Sun
    Shaoxi Cai
    Hu Mei
    Jian Li
    Ning Yan
    Yuanqiang Wang
    [J]. Journal of Molecular Modeling, 2010, 16 : 1809 - 1818
  • [9] Docking and 3D QSAR study of thiourea analogs as potent inhibitors of influenza virus neuraminidase
    Sun, Jiaying
    Cai, Shaoxi
    Mei, Hu
    Li, Jian
    Yan, Ning
    Wang, Yuanqiang
    [J]. JOURNAL OF MOLECULAR MODELING, 2010, 16 (12) : 1809 - 1818
  • [10] QSAR study of flavonoids and biflavonoids as influenza H1N1 virus neuraminidase inhibitors
    Mercader, Andrew G.
    Pomilio, Alicia B.
    [J]. EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, 2010, 45 (05) : 1724 - 1730