AIMC Topic: G-Protein-Coupled Receptor Kinase 5

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Unveiling G-protein coupled receptor kinase-5 inhibitors for chronic degenerative diseases: Multilayered prioritization employing explainable machine learning-driven multi-class QSAR, ligand-based pharmacophore and free energy-inspired molecular simulation.

International journal of biological macromolecules Apr 30, 2024
GRK5 holds a pivotal role in cellular signaling pathways, with its overexpression in cardiomyocytes, neuronal cells, and tumor cells strongly associated with various chronic degenerative diseases, which highlights the urgent need for potential inhibi...
Humans Machine Learning Molecular Docking Simulation Protein Binding Chronic Disease Molecular Dynamics Simulation Ligands Quantitative Structure-Activity Relationship Protein Kinase Inhibitors Binding Sites Thermodynamics Pharmacophore G-Protein-Coupled Receptor Kinase 5
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