Identification of chemogenomic features from drug–target interaction networks using interpretable classifiers
Author(s) -
Yasuo Tabei,
Edouard Pauwels,
Véronique Stoven,
Kazuhiro Takemoto,
Yoshihiro Yamanishi
Publication year - 2012
Publication title -
bioinformatics
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 3.599
H-Index - 390
eISSN - 1367-4811
pISSN - 1367-4803
DOI - 10.1093/bioinformatics/bts412
Subject(s) - drug target , computer science , classifier (uml) , identification (biology) , drug discovery , artificial intelligence , chemical space , virtual screening , interaction network , computational biology , applicability domain , machine learning , drug , pattern recognition (psychology) , quantitative structure–activity relationship , bioinformatics , biology , genetics , botany , pharmacology , gene
Drug effects are mainly caused by the interactions between drug molecules and their target proteins including primary targets and off-targets. Identification of the molecular mechanisms behind overall drug-target interactions is crucial in the drug design process.
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