Article

KnowMol: A Knowledge-Guided Multi-Agent Framework for Interpretable Drug–Target Interaction Prediction, Validated in PRMT3-Targeted NAFLD Therapy

2026-06-22

Abstract excerpt

<title>Abstract</title> <p>Drug--target binding prediction remains a major bottleneck in drug discovery, as it requires substantial computational and experimental resources. Molecular property prediction supports early candidate prioritization, but most existing methods provide only scores or labels without mechanistic evidence explaining why a molecule is suitable for a given target. Here, we present KnowMol, a...

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Literature Corpus work: 33a75b97-8bd4-5b65-8e41-f8a052259e43
DOI: 10.21203/rs.3.rs-9874962/v1

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