Representative exemplars
TopLeft: drTargetMolName. Top right: GLP1R PAM score. Down left: cluster ID. Down right: whether the score is from experimental values or predicted.
Interactions of compounds with relevant ChEMBL phenotypes.
Network view.
Interactions of compounds with relevant ChEMBL phenotypes.
TreeMap view.
Some of these compounds show activity in the PubChem screens used to build the machine learning model
