| Literature DB >> 24998378 |
Timothy J Hagen1, Xuesheng Mo2, Alex B Burgin3, David Fox3, Zheng Zhang4, Mark E Gurney5.
Abstract
In this study we report a series of triazine derivatives that are potent inhibitors of PDE4B. We also provide a series of structure activity relationships that demonstrate the triazine core can be used to generate subtype selective inhibitors of PDE4B versus PDE4D. A high resolution co-crystal structure shows that the inhibitors interact with a C-terminal regulatory helix (CR3) locking the enzyme in an inactive 'closed' conformation. The results show that the compounds interact with both catalytic domain and CR3 residues. This provides the first structure-based approach to engineer PDE4B-selective inhibitors.Entities:
Keywords: Crystallography; PDE4 inhibitor; PDE4B; PDE4D; Triazine
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Year: 2014 PMID: 24998378 PMCID: PMC4142572 DOI: 10.1016/j.bmcl.2014.06.002
Source DB: PubMed Journal: Bioorg Med Chem Lett ISSN: 0960-894X Impact factor: 2.823