Prioritizing Neuroactive Ligands Using Motif-Guided Virtual Discovery and Zebrafish Profiling
Ari Benjamin Ginsparg, Jaqueline A. Martinez, Ishaan U. Patel, Angélique Buton, L. Lee, Raheel Sarwar, Rocco Moretti, Stéphanie Puig, Summer B. Thyme
The paper develops a computational method to prioritize neuroactive ligands using structural data and zebrafish testing, identifying effective antagonists for hypocretin receptors.
npj Drug Discovery. · Jul 21, 2026Peer-reviewedPharmacology & Toxicology