3D-QSAR CoMFA studies on trypsin-like serine protease inhibitors: a comparative selectivity analysis

3D-QSAR/CoMFA models have been generated for a series of indole/benzoimidazole-5-carboxamidines as trypsin-like serine protease inhibitors viz. tPA, factor Xa, thrombin, plasmin, and trypsin, which can be employed in designing novel selective serine protease inhibitors of therapeutic interest. A ser...

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Veröffentlicht in:	Bioorganic & medicinal chemistry 2005-04, Vol.13 (8), p.2773-2782
Hauptverfasser:	Bhongade, Bhoomendra A., Gouripur, Veerappa V., Gadad, Andanappa K.
Format:	Artikel
Sprache:	eng
Schlagworte:	3D-QSAR Amidines - chemistry Amidines - pharmacology Anticancer Anticoagulants Antineoplastic agents Antithrombotic agents Biological and medical sciences Blood. Blood coagulation. Reticuloendothelial system CoMFA Crystallography, X-Ray Factor Xa Inhibitors Fibrinolysin - antagonists & inhibitors General aspects Indole/benzoimidazole-5-carboxamidines Medical sciences Miscellaneous Models, Molecular Pharmacology. Drug treatments Quantitative Structure-Activity Relationship Serine Endopeptidases - drug effects Serine Proteinase Inhibitors - chemistry Serine Proteinase Inhibitors - pharmacology Substrate Specificity Thrombin - antagonists & inhibitors Tissue Plasminogen Activator - antagonists & inhibitors Trypsin - drug effects Trypsin-like serine protease inhibitors Urokinase-Type Plasminogen Activator - antagonists & inhibitors
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