2iit

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[[Image:2iit.gif|left|200px]]
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{{STRUCTURE_2iit| PDB=2iit | SCENE= }}
{{STRUCTURE_2iit| PDB=2iit | SCENE= }}
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'''Human dipeptidyl peptidase 4 in complex with a diazepan-2-one inhibitor'''
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===Human dipeptidyl peptidase 4 in complex with a diazepan-2-one inhibitor===
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==Overview==
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Replacement of the triazolopiperazine ring of sitagliptin (DPP-4 IC(50)=18nM) with 3-(2,2,2-trifluoroethyl)-1,4-diazepan-2-one gave dipeptidyl peptidase IV (DPP-4) inhibitor 1 which is potent (DPP-4 IC(50)=2.6nM), selective, and efficacious in an oral glucose tolerance test in mice. It was selected for extensive preclinical development as a potential back-up candidate to sitagliptin.
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(as it appears on PubMed at http://www.pubmed.gov), where 17055272 is the PubMed ID number.
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{{ABSTRACT_PUBMED_17055272}}
==About this Structure==
==About this Structure==
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[[Category: Dimer]]
[[Category: Dimer]]
[[Category: Hydrolase]]
[[Category: Hydrolase]]
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Sun May 4 07:33:20 2008''
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Mon Jul 28 11:49:30 2008''

Revision as of 08:49, 28 July 2008

Image:2iit.png

Template:STRUCTURE 2iit

Human dipeptidyl peptidase 4 in complex with a diazepan-2-one inhibitor

Template:ABSTRACT PUBMED 17055272

About this Structure

2IIT is a Single protein structure of sequence from Homo sapiens. Full crystallographic information is available from OCA.

Reference

(3R)-4-[(3R)-3-Amino-4-(2,4,5-trifluorophenyl)butanoyl]-3-(2,2,2-trifluoro ethyl)-1,4-diazepan-2-one, a selective dipeptidyl peptidase IV inhibitor for the treatment of type 2 diabetes., Biftu T, Feng D, Qian X, Liang GB, Kieczykowski G, Eiermann G, He H, Leiting B, Lyons K, Petrov A, Sinha-Roy R, Zhang B, Scapin G, Patel S, Gao YD, Singh S, Wu J, Zhang X, Thornberry NA, Weber AE, Bioorg Med Chem Lett. 2007 Jan 1;17(1):49-52. Epub 2006 Oct 5. PMID:17055272

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