New insights into protein–protein interaction modulators in drug discovery and therapeutic advance

H Nada, Y Choi, S Kim, KS Jeong… - … and Targeted Therapy, 2024 - nature.com
Protein-protein interactions (PPIs) are fundamental to cellular signaling and transduction
which marks them as attractive therapeutic drug development targets. What were once …

Machine learning-based approach to develo** potent EGFR inhibitors for breast cancer─ design, synthesis, and in vitro evaluation

H Nada, AR Gul, A Elkamhawy, S Kim, M Kim… - ACS …, 2023 - ACS Publications
The epidermal growth factor receptor (EGFR) is vital for regulating cellular functions,
including cell division, migration, survival, apoptosis, angiogenesis, and cancer. EGFR …

Development of a machine learning‐based target‐specific scoring function for structure‐based binding affinity prediction for human dihydroorotate dehydrogenase …

J Meng, L Zhang, Z He, M Hu, J Liu… - Journal of …, 2025 - Wiley Online Library
Human dihydroorotate dehydrogenase (hDHODH) is a flavin mononucleotide‐dependent
enzyme that can limit de novo pyrimidine synthesis, making it a therapeutic target for …