Most of the natural products isolated at present are heterocyclic compounds, so heterocyclic compounds occupy an important position in the research of organic chemistry. A compound: 83435-58-9, is researched, SMILESS is O=C(N1[C@@H](CO)CCC1)OC(C)(C)C, Molecular C10H19NO3Journal, Article, Journal of Medicinal Chemistry called Discovery of 4-[(2S)-2-{[4-(4-Chlorophenoxy)phenoxy]methyl}-1-pyrrolidinyl]butanoic Acid (DG-051) as a Novel Leukotriene A4 Hydrolase Inhibitor of Leukotriene B4 Biosynthesis, Author is Sandanayaka, Vincent; Mamat, Bjorn; Mishra, Rama K.; Winger, Jennifer; Krohn, Michael; Zhou, Li-Ming; Keyvan, Monica; Enache, Livia; Sullins, David; Onua, Emmanuel; Zhang, Jun; Halldorsdottir, Gudrun; Sigthorsdottir, Heida; Thorlaksdottir, Audur; Sigthorsson, Gudmundur; Thorsteinnsdottir, Margret; Davies, Douglas R.; Stewart, Lance J.; Zembower, David E.; Andresson, Thorkell; Kiselyov, Alex S.; Singh, Jasbir; Gurney, Mark E., the main research direction is pyrrolidinylbutanoate preparation leukotriene hydrolase inhibitor SAR.HPLC of Formula: 83435-58-9.
Both inhouse human genetic and literature data have converged on the identification of leukotriene 4 hydrolase (LTA4H) as a key target for the treatment of cardiovascular disease. We combined fragment-based crystallog. screening with an iterative medicinal chem. effort to optimize inhibitors of LTA4H. Ligand efficiency was followed throughout our structure-activity studies. As applied within the context of LTA4H inhibitor design, the chem. team was able to design a potent compound 20 (DG-051, I) (Kd = 26 nM) with high aqueous solubility (>30 mg/mL) and high oral bioavailability (>80% across species) that is currently undergoing clin. evaluation for the treatment of myocardial infarction and stroke. The structural biol.-chem. interaction described in this paper provides a sound alternative to conventional screening techniques. This is the first example of a gene-to-clinic paradigm enabled by a fragment-based drug discovery effort.
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Reference:
Thiazole | C3H3NS – PubChem,
Thiazole | chemical compound | Britannica