caa a22 4500 378911309 CHVBK 20180305123542.0 cr unu---uuuuu 161128e20040101xx s 000 0 eng 10.1351/pac200476050997 doi (NATIONALLICENCE)gruyter-10.1351/pac200476050997 Development of modulators of multidrug resistance: A pharmacoinformatic approach [Elektronische Daten] [G. F. Ecker, Peter Chiba] Inhibition of drug efflux pumps such as P-glycoprotein represents a versatile approach for overcoming multidrug resistance in tumor therapy. Although numerous compounds have been identified as being able to inhibit P-glycoprotein, only little is known on the molecular basis of the drug-protein interaction. This article gives an overview of the different pharmacoinformatic approaches we used to develop new propafenone-type modulators of P-glycoprotein. These include 2D-and 3D-QSAR studies, artificial neural networks, and photoaffinity labeling studies. © 2013 Walter de Gruyter GmbH, Berlin/Boston Ecker G. F. Department of Pharmaceutical Chemistry, University of Vienna, Althanstrasse 14, 1090 Wien, Austria; Department of Medical Chemistry, Medical University of Vienna, Waehringer Strasse 10, 1090 Wien, Austria aut Chiba Peter Department of Pharmaceutical Chemistry, University of Vienna, Althanstrasse 14, 1090 Wien, Austria; Department of Medical Chemistry, Medical University of Vienna, Waehringer Strasse 10, 1090 Wien, Austria aut Pure and Applied Chemistry De Gruyter 76/5(2004-01-01), 997-1005 0033-4545 76:5<997 2004 76 pac https://doi.org/10.1351/pac200476050997 text/html Onlinezugriff via DOI 1 research article jats NATIONALLICENCE 856 40 https://doi.org/10.1351/pac200476050997 text/html Onlinezugriff via DOI NATIONALLICENCE 700 1- Ecker G. F. Department of Pharmaceutical Chemistry, University of Vienna, Althanstrasse 14, 1090 Wien, Austria; Department of Medical Chemistry, Medical University of Vienna, Waehringer Strasse 10, 1090 Wien, Austria aut NATIONALLICENCE 700 1- Chiba Peter Department of Pharmaceutical Chemistry, University of Vienna, Althanstrasse 14, 1090 Wien, Austria; Department of Medical Chemistry, Medical University of Vienna, Waehringer Strasse 10, 1090 Wien, Austria aut NATIONALLICENCE 773 0- Pure and Applied Chemistry De Gruyter 76/5(2004-01-01), 997-1005 0033-4545 76:5<997 2004 76 pac CC0 http://creativecommons.org/publicdomain/zero/1.0 nationallicence BK010053 XK010053 XK010000 NATIONALLICENCE NATIONALLICENCE NL-gruyter