PMID

Data

Article Title

Organization

Novel dabigatran derivatives with a fluorine atom at the C-2 position of the terminal benzene ring: Design, synthesis and anticoagulant activity evaluation.

Shanghai Institute of Technology

Design, synthesis, anticoagulant activity evaluation and molecular docking studies of a class of N-ethyl dabigatran derivatives.

Shanghai Institute of Technology

Molecular design, synthesis and anticoagulant activity evaluation of fluorinated dabigatran analogues.

Shanghai Institute of Technology

Discovery of bis-aryl urea derivatives as potent and selective Limk inhibitors: Exploring Limk1 activity and Limk1/ROCK2 selectivity through a combined computational study.

Shanghai Institute of Technology

Design, synthesis and structural exploration of novel fluorinated dabigatran derivatives as direct thrombin inhibitors.

Shanghai Institute of Technology

Discovery of potent and selective urea-based ROCK inhibitors: Exploring the inhibitor's potency and ROCK2/PKA selectivity by 3D-QSAR, molecular docking and molecular dynamics simulations.

Shanghai Institute of Technology

Molecular modeling studies of atorvastatin analogues as HMGR inhibitors using 3D-QSAR, molecular docking and molecular dynamics simulations.

Shanghai Institute of Technology

Design, synthesis and biological evaluation of combretastatin A-4 sulfamate derivatives as potential anti-cancer agents.

Shanghai Institute of Technology

Computer-aided discovery of phenylpyrazole based amides as potent S6K1 inhibitors.

Shanghai Institute of Technology

Discovery of novel pyrrolo[2,3-b]pyridine derivatives bearing 4-oxoquinoline moiety as potential antitumor inhibitor.

Shanghai Institute of Technology

Discovery of (S)-6-methoxy-chroman-3-carboxylic acid (4-pyridin-4-yl-phenyl)-amide as potent and isoform selective ROCK2 inhibitors.

Shanghai Institute of Technology

Discovery of novel acylhydrazone neuraminidase inhibitors.

Shanghai Institute of Technology

Discovery of Novel Neuraminidase Inhibitors by Structure-Based Virtual Screening, Structural Optimization, and Bioassay.

Shanghai Institute of Technology

Molecular modeling studies, synthesis and biological evaluation of dabigatran analogues as thrombin inhibitors.

Shanghai Institute of Technology

Design, synthesis and biological evaluation of novel oseltamivir derivatives as potent neuraminidase inhibitors.

Shanghai Institute of Technology

Discovery of (E)-1-amino-4-phenylbut-3-en-2-ol derivatives as novel neuraminidase inhibitors.

Shanghai Institute of Technology