In those cases, only actives and inactive molecules were considered (not decoys) and the GLIDE SP scores were used for the best pose of each ligand docked versus all the structures for a given target (i.e., the score for the specific docked solution that was used as model input and as defined by the protocol above). Altogether, we have designed a strategy to confidently augment data density taking advantage of the LO project data from Janssen. Moreover, we generated pose decoys to force the model to learn from interactions and generated challenging inactive datasets for each target following the same protocol.