2bhj

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{{STRUCTURE_2bhj| PDB=2bhj | SCENE= }}
{{STRUCTURE_2bhj| PDB=2bhj | SCENE= }}
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'''MURINE INO SYNTHASE WITH COUMARIN INHIBITOR'''
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===MURINE INO SYNTHASE WITH COUMARIN INHIBITOR===
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==Overview==
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Inducible nitric oxide synthase (iNOS) has been implicated in various central and peripheral pathophysiological diseases. Our high throughput screening initially identified a weak inhibitor of iNOS, thiocoumarin 13. From this lead, a number of potent derivatives were prepared that demonstrate favorable potency, selectivity and kinetics. Compound 30 has an IC50 of 60 nM for mouse iNOS and 185-fold and 9-fold selectivity for bovine eNOS and rat nNOS, respectively. In cellular assays for iNOS, this compound has micromolar potency. Furthermore, two compounds (16 and 30) demonstrate a reasonable pharmacokinetic profile in rodents. The synthesis, SAR, and biological activity of this novel class of compounds is described.
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(as it appears on PubMed at http://www.pubmed.gov), where 15781384 is the PubMed ID number.
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{{ABSTRACT_PUBMED_15781384}}
==About this Structure==
==About this Structure==
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[[Category: Polymorphism]]
[[Category: Polymorphism]]
[[Category: Zinc]]
[[Category: Zinc]]
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Sat May 3 20:17:41 2008''
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Tue Jul 29 13:10:48 2008''

Revision as of 10:10, 29 July 2008

Image:2bhj.png

Template:STRUCTURE 2bhj

MURINE INO SYNTHASE WITH COUMARIN INHIBITOR

Template:ABSTRACT PUBMED 15781384

About this Structure

2BHJ is a Single protein structure of sequence from Mus musculus. Full crystallographic information is available from OCA.

Reference

Design, synthesis and characterization of a novel class of coumarin-based inhibitors of inducible nitric oxide synthase., Jackson SA, Sahni S, Lee L, Luo Y, Nieduzak TR, Liang G, Chiang Y, Collar N, Fink D, He W, Laoui A, Merrill J, Boffey R, Crackett P, Rees B, Wong M, Guilloteau JP, Mathieu M, Rebello SS, Bioorg Med Chem. 2005 Apr 15;13(8):2723-39. PMID:15781384

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