Fig. 6: Docking results of the predicted interactions and performance comparison on different scales of labeled data. | Nature Communications

Fig. 6: Docking results of the predicted interactions and performance comparison on different scales of labeled data.

From: DTIAM: a unified framework for predicting drug-target interactions, binding affinities and drug mechanisms

Fig. 6

A–F The docked poses for the predicted interactions between six potential drugs (i.e., Palbociclib, Granisetron, Axitinib, Canertinib dihydrochloride, Doramapimod, and Mubritinib, where Palbociclib is the reference drug) and the CDK 6. G The performances of DTIAM and baseline models trained on different scales of labeled data (i.e., 20%, 40%, 60%, and 80%) in DTI, DTA, and MoA prediction tasks under the warm start settings.

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