Discovery of Novel MsbA Inhibitors with a Bivalent Molecular Generative Model.
Sign Up to like & getrecommendations! Published in 2025 at "Journal of chemical information and modeling"
DOI: 10.1021/acs.jcim.5c01426
Abstract: MsbA, a bacterial ABC transporter essential for lipopolysaccharide (LPS) transport, is a promising target for treating multidrug-resistant infections. However, developing potent MsbA inhibitors remains challenging. Recently, cerastecin C, representing a class of bivalent inhibitors targeting… read more here.
Keywords: bivalent molecular; generative model; molecular generative; msba inhibitors ... See more keywords