Structure-based design and synthesis of novel non-zinc chelating MMP-12 inhibitors
Structure-based design and synthesis of novel non-zinc chelating MMP-12 inhibitors
复制标题
DOI：
10.1016/j.bmcl.2005.05.079
复制
发表时间：
2005-08-15
影响因子：
2.7
通讯作者：
Tertre, A
中科院分区：
文献类型：
--
作者：
Dublanchet, AC;Ducrot, P;Tertre, A
使用基于结构的药物设计方法发现并优化了一类新的 MMP-12 抑制剂。使用已知的 MMP-12 晶体结构进行的建模研究确定了这些新型 MMP-12 抑制剂的新相互作用模式。进一步优化发现了一种对 MMP-12 表现出纳摩尔活性的化合物，并且该化合物与 MMP-12 共结晶。 (c) 2005 Elsevier Ltd. 保留所有权利。
A new class of MMP-12 inhibitors was discovered and optimized using structure-based drug design methods. Modeling studies using a known MMP-12 crystal structure identified a new interaction mode for these new MMP-12 inhibitors. Further optimization resulted in the discovery of a compound displaying nanomolar activity against MMP-12 and which was co-crystallized with MMP-12. (c) 2005 Elsevier Ltd. All rights reserved.