sc-514 has been researched along with Edema* in 1 studies
1 other study(ies) available for sc-514 and Edema
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Structure-based design and biological profile of (E)-N-(4-Nitrobenzylidene)-2-naphthohydrazide, a novel small molecule inhibitor of IκB kinase-β.
In this study, we describe the rational design, molecular modeling and pharmacological profile of a novel IKK-β inhibitor (E)-N-(4-nitrobenzylidene)-2-naphthohydrazide (LASSBio-1524). The design based on the IKK-β active site, and a privileged structure template yielded a novel IKK-β inhibitor scaffold with significant selectivity over IKK-α and CHK2, as assessed by an in vitro kinase assay. For a better understanding of the structural requirements of IKK-β inhibition, molecular dynamics simulations of LASSBio-1524 (3) were performed. The NAH derivative LASSBio-1524 (3), was able to suppress arachidonic acid-induced edema formation in a dose-dependent manner, demonstrating an in vivo anti-inflammatory effect. The molecular architecture of this novel, low-molecular weight IKK-β inhibitor is encouraging for further lead optimization toward the development of innovative anti-inflammatory drug candidates. Topics: Amino Acid Sequence; Animals; Anti-Inflammatory Agents; Benzylidene Compounds; Catalytic Domain; Cell Line; Drug Design; Edema; Female; Humans; Hydrazones; I-kappa B Kinase; Ligands; Male; Mice; Molecular Dynamics Simulation; Molecular Sequence Data; Molecular Weight; Protein Kinase Inhibitors | 2011 |