Rationalizing Predictions of Isoform-Selective Phosphoinositide 3-Kinase Inhibitors Using MolAnchor Analysis
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DOI: 10.1021/acs.jcim.4c02153
Abstract: Explaining the predictions of machine learning models is of critical importance for integrating predictive modeling in drug discovery projects. We have generated a test system for predicting isoform selectivity of phosphoinositide 3-kinase (PI3K) inhibitors and… read more here.
Keywords: inhibitors using; molanchor; phosphoinositide kinase; isoform selective ... See more keywords