Analysis of in vitro bioactivity data extracted from drug discovery literature and patents: Ranking 1654 human protein targets by assayed compounds and molecular scaffolds.
Christopher SouthanKiran BoppanaSarma A. R. P. JagarlapudiSorel MuresanPublished in: J. Cheminformatics (2011)
Keyphrases
- drug discovery
- chemical compounds
- virtual screening
- statistical analysis
- data mining tools
- data analysis
- drug design
- pharmaceutical industry
- knowledge discovery
- data sets
- early stage
- biological systems
- database
- data acquisition
- systems biology
- data mining
- databases
- data mining methods
- mass spectrometry
- database systems
- network structure
- high dimensional data
- data collection