Explainable Artificial Intelligence (xAI) for 5-HT2A Receptor Binding Affinity of New Psychoactive Substances.
Molecules June 1, 2026 Verena Schöning, Katharina Elisabeth Grafinger, Daniel Pasin et al.
New psychoactive substances (NPS) are a heterogeneous group of recreational drugs that mimic the actions and psychoactive effects of existing pharmaceutical products or recreational drugs. As NPS can be highly potent, even exceeding their template compound's potency, there are frequent reports of non-fatal and fatal intoxications. One principal target for hallucinogenic and psychedelic drugs,...
DOI: 10.3390/molecules31111888 (opens in new tab)
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5-ht2a
Nps
Binding affinity
Classification model
+2