SPRINT
Ultrafast drug-target interaction screening
SPRINT co-embeds ligands (Morgan fingerprints) and proteins (structure-aware SaProt embeddings) in a shared latent space so interaction prediction reduces to a dot product. Screen compound libraries against a curated panel of named drug targets from the DAVIS, BIOSNAP and BindingDB datasets, or identify the most likely targets for a single compound. Scored with the released MERGED checkpoint.
SPRINT is live on MolPilot — paste a sequence and press Fold.
At a glance
- Input
- Compound library (SMILES)
- Output
- DTI probabilities (CSV)
- Developed by
- Carnegie Mellon University
- Published
- Adduri et al., 2024 · 2024
#dti#virtual-screening#binding-prediction
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