Comparison and Druggability Prediction of Protein-Ligand Binding Sites from Pharmacophore-Annotated Cavity Shapes.
Jérémy DesaphyKarima AzdimousaEsther KellenbergerDidier RognanPublished in: J. Chem. Inf. Model. (2012)
Keyphrases
- binding sites
- protein protein
- protein interaction
- virtual screening
- dna binding
- sequence alignment
- gene expression
- dna sequences
- transcription factors
- regulatory elements
- sequence data
- motif discovery
- transcription factor binding sites
- statistical significance
- drosophila melanogaster
- predicting protein
- biological sequences
- protein complexes
- drug design
- protein families
- protein interaction networks
- influenza virus
- protein structure prediction
- protein function
- regulatory networks
- protein sequences
- machine learning
- drug discovery
- cis regulatory
- microarray
- statistically significant
- transcriptional regulation