Abstract
We have previously reported a novel series of oxalyl-aryl-amino benzoic acid-based, catalytic site-directed, competitive, reversible protein tyrosine phosphatase 1B (PTP1B) inhibitors. With readily access to key intermediates, we utilized a solution phase parallel synthesis approach and rapidly identified a highly potent PTP1B inhibitor (19, K(i)=76 nM) with moderate selectivity (5-fold) over T-cell PTPase (TCPTP) through interacting with a second phosphotyrosine binding site (site 2) in the close proximity to the catalytic site.
MeSH terms
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Amides / chemistry
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Amides / pharmacology
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Benzoates / chemistry*
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Benzoates / pharmacology*
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Binding Sites
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Catalytic Domain
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Combinatorial Chemistry Techniques
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Crystallography, X-Ray
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Enzyme Inhibitors / chemistry*
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Enzyme Inhibitors / pharmacology*
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Ligands
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Molecular Structure
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Phosphotyrosine / metabolism
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Protein Tyrosine Phosphatase, Non-Receptor Type 1
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Protein Tyrosine Phosphatases / antagonists & inhibitors*
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Structure-Activity Relationship
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T-Lymphocytes / enzymology
Substances
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Amides
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Benzoates
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Enzyme Inhibitors
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Ligands
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Phosphotyrosine
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Protein Tyrosine Phosphatase, Non-Receptor Type 1
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Protein Tyrosine Phosphatases