Jul 2026
A synergistic deep learning and machine learning framework for screening heterocyclic compounds against ALDH1A1.
An integrated computer-aided drug design (CADD) and artificial intelligence (AI) framework to systematically identify selective ALDH1A1 inhibitors from a heterocyclic compound library is developed and suggests that LDN-27219 exhibits favorable binding characteristics and represents a promising lead candidate for subseq...
Shu-Chi Cho, Yi-Wen Wang, Chien-An Chu et al.
· Molecular diversity · 0 citations