Discovery of new PKN2 inhibitory chemotypes via QSAR-guided selection of docking-based pharmacophores
Mahmoud A. Al-Sha’er, Haneen A. Basheer, Mutasem O. Taha
Topics & Concepts
PharmacophoreVirtual screeningQuantitative structure–activity relationshipDocking (animal)ChemistryComputational biologyCancer cellContext (archaeology)StereochemistryCancerBiologyGeneticsPaleontologyNursingMedicineComputational Drug Discovery MethodsClick Chemistry and ApplicationsChemical Synthesis and Analysis