Identification of potent and selective TACE inhibitors via the S1 pocket.

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Condon JS, Joseph-McCarthy D, Levin JI, Lombart HG, Lovering FE, Sun L, Wang W, Xu W, Zhang Y

Identification of potent and selective TACE inhibitors via the S1 pocket.

Bioorg Med Chem Lett. 2007 Jan 1;17(1):34-9. Epub 2006 Oct 5.

PubMed ID

17064892 [ View in PubMed

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Abstract

By focusing on the P1 portion of the piperidine beta-sulfone ligands we identified a motif that induces selectivity and resulted in a series of TACE inhibitors that demonstrated excellent in vitro potency against isolated TACE enzyme and excellent selectivity over MMPs 1, 2, 9, 13, and 14.

DrugBank Data that Cites this Article

Binding Properties

Drug	Target	Property	Measurement	pH	Temperature (°C)
(2R)-N-HYDROXY-2-[(3S)-3-METHYL-3-{4-[(2-METHYLQUINOLIN-4-YL)METHOXY]PHENYL}-2-OXOPYRROLIDIN-1-YL]PROPANAMIDE	Disintegrin and metalloproteinase domain-containing protein 17	IC 50 (nM)	0.56	N/A	N/A	Details