哌嗪磺胺 BACE1 抑制剂：设计、合成与体内特征描述。
Piperazine sulfonamide BACE1 inhibitors: design, synthesis, and in vivo characterization.
机构信息
Merck Research Laboratories, 2015 Galloping Hill Road, Kenilworth, NJ 07033, USA.
出版信息
Bioorg Med Chem Lett. 2010 May 1;20(9):2837-42. doi: 10.1016/j.bmcl.2010.03.050. Epub 2010 Mar 12.
PMID:20347593
Abstract
With collaboration between chemistry, X-ray crystallography, and molecular modeling, we designed and synthesized a series of novel piperazine sulfonamide BACE1 inhibitors. Iterative exploration of the non-prime side and S2' sub-pocket of the enzyme culminated in identification of an analog that potently lowers peripheral Abeta(40) in transgenic mice with a single subcutaneous dose.
摘要
通过化学、X 射线晶体学和分子建模的合作，我们设计并合成了一系列新型哌嗪磺酰胺 BACE1 抑制剂。对酶的非主链侧和 S2'亚口袋的反复探索最终确定了一种类似物，该类似物在转基因小鼠中单次皮下给药即可有效降低外周 Abeta(40)。
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