Ferroptosis represents a promising therapeutic strategy for esophageal squamous cell carcinoma (ESCC), but its efficacy is often limited by intrinsic metabolic defenses. Herein, arachidonic acid (AA) acts as a potent sensitizer for class I histone deacetylase (HDAC) inhibitor-induced ferroptosis. Guided by the bindin...
Meng Liu, Shan Gao, Chen Chen et al.· Journal of Medicinal Chemist...· 0 citations
Targeted protein degradation (TPD) has become a novel therapeutic modality for diseases in drug discovery. Most progress on TPD has focused on the ubiquitin proteasome system; however, only a handful of >600 human genome-encoded E3 ligases have been successfully applied. Expansion of the E3 ligase toolbox with novel E3...
Bo Zhang, Shi-Ji Zhang, Ren-Shuai Liu et al.· RSC Medicinal Chemistry· 0 citations
The performance of target-specific, ligand-based virtual screening models is strongly influenced by dataset characteristics, including data availability, class imbalance, and evaluation strategies. In this work, we perform a systematic evaluation of graph neural networks (GNNs) using a ChEMBL-derived dataset spanning...
Hai-Han Liu, Jia-Qi Lin, Ying Fan et al.· Journal of Chemical Informat...· 0 citations
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