BioinformaticsbioRxivPreprint
A Novel Machine Learning Approach Uncovers New and Distinctive Inhibitors for Cyclin-Dependent Kinase 9
Mariana Aßmann, Matthias Bal, Michael Craig…·Vid Stojevic
This study introduces a machine learning method that discovers new CDK9 inhibitors with high binding affinity and synthetic feasibility, achieving a 10% hit rate in biochemical assays.