Results 161 to 170 of about 25,555 (231)

Water-Based Pharmacophore Modeling in Kinase Inhibitor Design: A Case Study on Fyn and Lyn Protein Kinases. [PDF]

J Chem Inf Model
Ljubič M, Sollner Dolenc M, Borišek J, Perdih A.   +3 more
europepmc   +1 more source

Triazole and Pyrazole Hybrids of Electrophilic Natural Products as Promising Anticancer Agents. [PDF]

Molecules
Fermo AD, Bisi A, Orioli R, Gobbi S, Belluti F.   +4 more
europepmc   +1 more source

Rescuing Verubecestat: An Integrative Molecular Modeling and Simulation Approach for Designing Next-Generation BACE1 Inhibitors. [PDF]

Int J Mol Sci
Dermawan D, Alotaiq N.
europepmc   +1 more source

AI-assisted identification of innovative phytochemicals from Aizoon canariense aimed at brachyury protein in chordoma: a computational strategy. [PDF]

Sci Rep
Alshammari SO.
europepmc   +1 more source

SIRT7 as a context-dependent biomarker and therapeutic target: Insights from a pan-cancer study. [PDF]

PLoS One
Islam KMT, Mahmud S.
europepmc   +1 more source

Identification of novel potent peptide inhibitors targeting the polo-box domain of PLK1: structure-based pharmacophore modelling, virtual screening, molecular docking, molecular dynamics study and biological evaluation. [PDF]

J Enzyme Inhib Med Chem
Zhou H, Guan L, Lin G, Yang X, Zhang X, Si Y, Zhang Y, Chen J.   +7 more
europepmc   +1 more source

Identification of novel PTP1B inhibitor for the treatment of LPS-induced myocardial apoptosis: machine learning based virtual screening and biological evaluation. [PDF]

J Enzyme Inhib Med Chem
Dong X, Shang B, Li X, Zhang J, Liu Z, Feng B.   +5 more
europepmc   +1 more source

Uncovering Major Structural and Functional Features of Methyl-Coenzyme M Reductase (MCR) from Methanobrevibacter ruminantium in Complex with Two Substrates. [PDF]

Int J Mol Sci
Chai HH, Park W, Lim D.
europepmc   +1 more source