DeorphaNN: Virtual screening of GPCR peptide agonists using AlphaFold-predicted active-state complexes and deep learning embeddings
Larissa Ferguson, Sébastien Ouellet, Elke Vandewyer, Christopher Wang, Zaw Wunna, Tony K.Y. Lim, William R Schafer, Isabel Beets
DeorphaNN identifies peptide agonists for GPCRs using AlphaFold structural predictions and deep learning embeddings, successfully uncovering agonists for two orphan receptors across species.
Molecular Cell · Jul 23, 2026Peer-reviewedBioinformatics