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Eur J Med Chem ; 46(11): 5549-55, 2011 Nov.
Article in English | MEDLINE | ID: mdl-21963348

ABSTRACT

Central heteroaryl ring analogues belonging to a series of potent hydroxamate TACE inhibitors were synthesized. The TACE inhibitory activities of these compounds were evaluated by in vitro WBA and in silico molecular modeling studies using crystal structure of human TACE. Compound 14 showed very good in vitro inhibition, supported by the in silico docking studies.


Subject(s)
ADAM Proteins/antagonists & inhibitors , Chemistry Techniques, Synthetic , Hydroxamic Acids/chemical synthesis , Hydroxamic Acids/pharmacology , Models, Molecular , Protease Inhibitors/chemical synthesis , Protease Inhibitors/pharmacology , ADAM Proteins/chemistry , ADAM Proteins/metabolism , ADAM17 Protein , Drug Discovery , Humans , Hydroxamic Acids/chemistry , Protease Inhibitors/chemistry , Protein Conformation , Tumor Necrosis Factor-alpha/antagonists & inhibitors
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