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IRAK-4 inhibitors. Part II: a structure-based assessment of imidazo[1,2-a]pyridine binding.
- Source :
-
Bioorganic & medicinal chemistry letters [Bioorg Med Chem Lett] 2008 Jun 01; Vol. 18 (11), pp. 3291-5. Date of Electronic Publication: 2008 Apr 22. - Publication Year :
- 2008
-
Abstract
- A potent IRAK-4 inhibitor was identified through routine project cross screening. The binding mode was inferred using a combination of in silico docking into an IRAK-4 homology model, surrogate crystal structure analysis and chemical analogue SAR.
- Subjects :
- Binding Sites
Crystallography, X-Ray
Enzyme Inhibitors chemistry
Imidazoles chemistry
Molecular Conformation
Molecular Structure
Pyridines chemistry
Structure-Activity Relationship
Drug Design
Enzyme Inhibitors chemical synthesis
Enzyme Inhibitors pharmacology
Imidazoles chemical synthesis
Imidazoles pharmacology
Interleukin-1 Receptor-Associated Kinases antagonists & inhibitors
Models, Molecular
Pyridines chemical synthesis
Pyridines pharmacology
Subjects
Details
- Language :
- English
- ISSN :
- 1464-3405
- Volume :
- 18
- Issue :
- 11
- Database :
- MEDLINE
- Journal :
- Bioorganic & medicinal chemistry letters
- Publication Type :
- Academic Journal
- Accession number :
- 18482836
- Full Text :
- https://doi.org/10.1016/j.bmcl.2008.04.039