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◆ Nucleic Acids Research2026-04-16· Interpretability

DeepKinomeWeb: a quantitative, panel-level platform for kinase inhibitor screening and selectivity profiling

Jisu Eun, Yeeun Lee, Seunghoon Yang, Donghwan Choi, 나현수, Hyeyun Cho, Seungyoon Nam, Jinhyuk Lee

原始摘要(英文原文)· Original abstract
Protein kinases are central targets in drug discovery, yet early-stage development of potent and selective inhibitors remains challenging due to high experimental costs and limited interpretability of large-scale screening data. Here, we present DeepKinomeWeb, an integrated web-based platform that transforms competition-based high-throughput screening data into actionable insights for kinase inhibitor prioritization. Built upon our previously validated deep learning regression model, DeepKinome, the platform enables quantitative prediction of kinase-inhibitor binding affinities and provides panel-level visualization of selectivity landscapes, selectivity metric calculations, and integrated structural and physicochemical analyses. Through its user-friendly interface, DeepKinomeWeb supports rational, data-driven decision-making for biologists and medicinal chemists, lowering the barrier to systematic selectivity assessment in kinase inhibitor discovery. DeepKinomeWeb is freely available to all users without any login requirement at https://str.kribb.re.kr/deepkinome.
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