ICCAS OpenIR
A Network-Based Multi-Target Computational Estimation Scheme for Anticoagulant Activities of Compounds
Li, Qian1,2,4; Li, Xudong1; Li, Canghai3; Chen, Lirong1; Song, Jun3; Tang, Yalin2; Xu, Xiaojie1
2011-03-22
Source PublicationPLOS ONE
ISSN1932-6203
Volume6Issue:3
AbstractBackground: Traditional virtual screening method pays more attention on predicted binding affinity between drug molecule and target related to a certain disease instead of phenotypic data of drug molecule against disease system, as is often less effective on discovery of the drug which is used to treat many types of complex diseases. Virtual screening against a complex disease by general network estimation has become feasible with the development of network biology and system biology. More effective methods of computational estimation for the whole efficacy of a compound in a complex disease system are needed, given the distinct weightiness of the different target in a biological process and the standpoint that partial inhibition of several targets can be more efficient than the complete inhibition of a single target.
DOI10.1371/journal.pone.0014774
Indexed BySCI
Language英语
WOS IDWOS:000288809100001
PublisherPUBLIC LIBRARY SCIENCE
Citation statistics
Cited Times:20[WOS]   [WOS Record]     [Related Records in WOS]
Document Type期刊论文
Identifierhttp://ir.iccas.ac.cn/handle/121111/72094
Collection中国科学院化学研究所
Corresponding AuthorLi, Qian
Affiliation1.Peking Univ, Beijing Natl Lab Mol Sci, State Key Lab Rare Earth Mat Chem & Applicat, Coll Chem & Mol Engn, Beijing 100871, Peoples R China
2.Chinese Acad Sci, Inst Chem, State Key Lab Struct Chem Unstable & Stable Speci, Beijing Natl Lab Mol Sci,Ctr Mol Sci, Beijing 100080, Peoples R China
3.China Acad Chinese Med Sci, Expt Res Ctr, Beijing, Peoples R China
4.Chinese Acad Sci, Grad Univ, Beijing, Peoples R China
Recommended Citation
GB/T 7714
Li, Qian,Li, Xudong,Li, Canghai,et al. A Network-Based Multi-Target Computational Estimation Scheme for Anticoagulant Activities of Compounds[J]. PLOS ONE,2011,6(3).
APA Li, Qian.,Li, Xudong.,Li, Canghai.,Chen, Lirong.,Song, Jun.,...&Xu, Xiaojie.(2011).A Network-Based Multi-Target Computational Estimation Scheme for Anticoagulant Activities of Compounds.PLOS ONE,6(3).
MLA Li, Qian,et al."A Network-Based Multi-Target Computational Estimation Scheme for Anticoagulant Activities of Compounds".PLOS ONE 6.3(2011).
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