期刊
JOURNAL OF MEDICINAL CHEMISTRY
卷 45, 期 23, 页码 4954-4957出版社
AMER CHEMICAL SOC
DOI: 10.1021/jm0255670
关键词
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New gamma-lactam. TACE inhibitors were designed from known MMP inhibitors. A homology model of TACE was built and examined to identify the S1' site as the key area for TACE selectivity over MMPs. Rational exploration of the P1'-S1' interactions resulted in the discovery of the 3,5-disubstituted benzyl ether as a TACE-selective P1' group. Further optimization led to the discovery of IK682 as a selective and orally bioavailable TACE inhibitor.
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