Open access
Jul 2026
ColdstartMHDTI: integrating biomolecular pretraining and attention-based heterogeneous graph learning for drug–target interaction prediction
ColdstartMHDTI is proposed, a two-stage framework for heterogeneous-graph-based DTI prediction that integrates sequence-derived structural representations with local and global relational information and supports candidate prioritization for downstream screening and evidence-guided hypothesis generation.
Hongyang Yang, Xiucai Ye, Huipu Han et al.
· Frontiers in Chemistry · 0 citations