ProfhEX: AI-based platform for small molecules liability profiling

ProfhEX: AI-based platform for small molecules liability profiling

Abstract Off-target drug interactions are a major reason for candidate failure in the drug discovery process. Anticipating potential drug’s adverse effects in the early stages is necessary to minimize health risks to patients, animal testing, and economical costs. With the constantly increasing size...

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Bibliographic Details
Main Authors: Filippo Lunghini, Anna Fava, Vincenzo Pisapia, Francesco Sacco, Daniela Iaconis, Andrea Rosario Beccari
Format: Article
Language:English
Published: BMC 2023-06-01
Series:Journal of Cheminformatics
Subjects:
Virtual screening
Liability profiling
Polypharmacology
Machine learning
Webservice
Online Access:https://doi.org/10.1186/s13321-023-00728-6

Internet

https://doi.org/10.1186/s13321-023-00728-6

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