Synthesis, structural characterization and molecular docking analysis of novel β-ketoiminato palladium( ii ) complexes with anticancer properties
Abstract
substituents reduced the affinity due to steric effects. Docking against PIK3CA-E545K produced binding energies that qualitatively paralleled several of the measured MCF-7 selectivity indices, with planar aromatic interactions and hydrophobic contacts defining the structure-activity relationships.
Fields of Study & Subjects
Synthesis and Reactivity of Heterocycles
Enzyme function and inhibition
Metal complexes synthesis and properties
Publication details
- Journal / source
- RSC Advances
- Publisher
- Royal Society of Chemistry (RSC)
- Volume
- 16
- Issue
- 25
- Pages
- 22352–22367
- Publication date
- 1 January 2026
- Language
- EN