Protein domain-based prediction of drug/compound-target interactions and experimental validation on LIM kinases.
Tunca DoganEce Akhan GüzelcanMarcus BaumannAltay KoyasHeval AtasIan R. BaxendaleMaria Jesus MartinRengül Çetin-AtalayPublished in: PLoS Comput. Biol. (2021)
Keyphrases
- drug design
- protein interaction
- physico chemical
- subcellular localization
- drug discovery
- prediction accuracy
- contact map
- protein chains
- protein structure prediction
- protein structure
- domain independent
- protein homology
- prediction error
- chemical compounds
- domain experts
- protein protein
- dna binding
- domain specific
- protein tertiary structure
- protein secondary structure
- virtual screening
- systems biology
- prediction model
- predicting protein
- remote homology detection
- computational methods
- protein protein interactions