Publications, Patents, Books and Book Chapters


Sort by: Date | Author | Title

184 Results
Ecker, G & Thai, KM 2008, 'A binary QSAR model for classification of hERG potassium channel blockers' Bioorganic & Medicinal Chemistry, vol 16, no. 16, pp. 4107-4119.

more...

Jurik, A, Zdrazil, B, Holy, M, Stockner, T, Sitte, HH & Ecker, G 2015, 'A Binding Mode Hypothesis of Tiagabine Confirms Liothyronine Effect on γ-Aminobutyric Acid Transporter 1 (GAT1)' Journal of Medicinal Chemistry, vol 58, no. 5. DOI: 10.1021/jm5015428

more...

Ecker, G, Chiba, P, Schaper, K-J & Hitzler, M 1998, 'A combined Hansch/Free-Wilson approach as predictive tool in QSAR studies on propafenone-type modulators of multidrug resistance' Archiv der Pharmazie, vol 331, pp. 233-240.

more...

Blaschke, M, McKinnon, R, Nguyen, CH, Holzner, S, Zehl, M, Atanasov, AG, Schelch, K, Krieger, S, Diaz, R, Frisch, R, Feistel, B, Jäger, W, Ecker, GF, Dirsch, VM, Grusch, M, Zupko, I, Urban, E, Kopp, B & Krupitza, G 2015, 'A eudesmane-type sesquiterpene isolated from Pluchea odorata (L.) Cass. combats three hallmarks of cancer cells: Unrestricted proliferation, escape from apoptosis and early metastatic outgrowth in vitro' Mutation Research: fundamental and molecular mechanisms of mutagenesis, vol 777, pp. 79-90. DOI: 10.1016/j.mrfmmm.2015.04.011

more...

Sase, A, Aher, YD, Saroja, SR, Ganesan, MK, Sase, S, Holy, M, Höger, H, Bakulev, V, Ecker, GF, Langer, T, Sitte, HH, Leban, J & Lubec, G 2016, 'A heterocyclic compound CE-103 inhibits dopamine reuptake and modulates dopamine transporter and dopamine D1-D3 containing receptor complexes' Neuropharmacology, vol 102, pp. 186-196. DOI: 10.1016/j.neuropharm.2015.07.039

more...

Annibali, D, Ecker, G, Fleischhacker, W, Helml, T, Holzer, W & Noe, C 2000, 'A method for the synthesis of 2,3-disubstituted 2,3-dihydrobenzofurans' Monatshefte für Chemie: an international journal of chemistry, vol 131, no. 4, pp. 375-382. DOI: 10.1007/s007060050318

more...

Michl, J, Scharinger, C, Zauner, M, Kasper, S, Freissmuth, M, Sitte, HH, Ecker, GF & Pezawas, L 2014, 'A multivariate approach linking reported side effects of clinical antidepressant and antipsychotic trials to in vitro binding affinities' European Neuropsychopharmacology, vol 24, no. 9, pp. 1463-1474. DOI: 10.1016/j.euroneuro.2014.06.013

more...

Neuhaus, W, Ölzant, S, Fringeli, UP, Ecker, G & Noe, C 2006, 'A novel flow based hollow-fiber blood-brain barrier in vitro model with immortalised cell line PBMEC/C1-2' Journal of Biotechnology, vol 125, no. 1, pp. 127-141. DOI: 10.1016/j.jbiotec.2006.02.019

more...

Fleischhacker, W, Ecker, G & Wolschann, KP 1998, 'A quantum chemical study of levcromakalim' Monatshefte für Chemie: an international journal of chemistry, vol 129, pp. 633-642.

more...

Baur, R, Lüscher, BP, Richter, L & Sigel, E 2010, 'A residue close to alpha(1) loop F disrupts modulation of GABA(A) receptors by benzodiazepines while their binding is maintained' Journal of Neurochemistry, vol 115, no. 6, pp. 1478-1485. DOI: 10.1111/j.1471-4159.2010.07052.x

more...

Schmid, D, Staudacher, DL, Löw, H-G, Spieckermann, PG, Ecker, G & Chiba, P 2003, 'A Subset of Highly Effective Propafenone-Type Multidrug Resistance Modulators Lacks Effects on Cardiac Action Potential and Mechanical Twitch Parameters of Rat Papillary Muscles' Journal of Pharmacology and Experimental Therapeutics, vol 307, no. 2, pp. 589-596.

more...

Ecker, G, Pleban, K, Kopp, S, Csaszar, E, Poelarends, GJ, Putman, M, Kaiser, D, Konings, WN & Chiba, P 2004, 'A three-dimensional model for the substrate binding domain of the multidrug ATP binding cassette transporter LmrA' Molecular Pharmacology, vol 66, no. 5, pp. 1169-1179. DOI: 10.1124/mol.104.001420

more...

Ecker, G & Chiba, P 2009, ABC-transporters – from target to antitarget. in E Gerhard & C Peter (eds), Transporters as Drug Carriers. Unknown publisher.

more...

Hofmaier, T, Luf, A, Seddik, A, Stockner, T, Holy, M, Freissmuth, M, Ecker, GF, Schmid, R, Sitte, HH & Kudlacek, O 2014, 'Aminorex, a metabolite of the cocaine adulterant levamisole, exerts amphetamine like actions at monoamine transporters' Neurochemistry International, vol 73, pp. 32-41. DOI: 10.1016/j.neuint.2013.11.010

more...

Buchmayer, F, Schicker, K, Steinkellner, T, Geier, P, Stübiger, G, Hamilton, PJ, Jurik, A, Stockner, T, Yang, J-W, Montgomery, T, Holy, M, Hofmaier, T, Kudlacek, O, Matthies, HJG, Ecker, GF, Bochkov, V, Galli, A, Boehm, S & Sitte, HH 2013, 'Amphetamine actions at the serotonin transporter rely on the availability of phosphatidylinositol-4,5-bisphosphate' Proceedings of the National Academy of Sciences of the United States of America (PNAS), vol 110, no. 28, pp. 11642-11647. DOI: 10.1073/pnas.1220552110

more...

Pinto, M, Trauner, M & Ecker, G 2012, 'An In Silico Classification Model for Putative ABCC2 Substrates.' Molecular Informatics, vol 31, no. 8, pp. 547-553. DOI: 10.1002/minf.201200049

more...

Bauer, R, Lauer, R, Linz, B, Pittner, F, Peschek, G, Ecker, G, Friedl, P & Noe, C 2002, 'An in vitro model for blood brain barrier permeation' Scientia Pharmaceutica, vol 70, no. 4, pp. 317-324.

more...

Ecker, G, Richter, L, Clayton, T, Chen, JL, Cromer, BA, Morton, CJ, Ng, H, Cook, JM, Helmstetter, FJ, Sieghart, W, Ernst, M, Furtmüller, R, Parker, MW & Kaczorowski, CC 2007, 'An updated unified pharmacophore model of the benzodiazepine binding site on gamma-aminobutyric acid receptors: correlation with comparative models' Current Medicinal Chemistry, pp. 2755-2775.

more...

Zdrazil, B, Pinto, M, Poongavanam, V, Williams, AJ, Balderud, LZ, Engkvist, O, Chichester, C, Hersey, A, Overington, JP & Ecker, G 2012, 'Annotating Human P-Glycoprotein Bioassay Data' Molecular Informatics, vol 31, no. 8, pp. 599-609. DOI: 10.1002/minf.201200059

more...

Schwanke, A, Murruzzu, C, Zdrazil, B, Zuhse, R, Natek, M, Höltje, M, Korting, HC, Reißig, H-U, Höltje, H-D & Schäfer-Korting, M 2010, 'Antitumor effects of guanosine-analog phosphonates identified by molecular modelling' International Journal of Pharmaceutics, vol 285, pp. 10924-10938.

more...

Carrió, P, Pinto, M, Ecker, G, Sanz, F & Pastor, M 2014, 'Applicability Domain ANalysis (ADAN): a robust method for assessing the reliability of drug property predictions' Journal of Chemical Information and Modeling, vol 54, no. 5, pp. 1500-11. DOI: 10.1021/ci500172z

more...

Ecker, G, Fleischhacker, W, Schaper, K-J & Chiba, P 1999, 'Artificial neural networks as versatile tools for prediction of MDR-modulatory activity' Advances in Experimental Medicine and Biology, vol 457, pp. 95-105.

more...

Kaiser, D, Hoffer, C, Chiba, P, Schaper, K-J & Ecker, G 2000, 'Artificial neural networks in drug design II: Influence of learning rate and momentum factor on the predictive ability' Scientia Pharmaceutica, vol 68, no. 1, pp. 57-64.

more...

Montanari, F & Ecker, G 2014, 'BCRP Inhibition: from Data Collection to Ligand-Based Modeling' Molecular Informatics, vol 33, no. 5, pp. 322-331. DOI: 10.1002/minf.201400012

more...

Dossetter, AG, Ecker, G, Laverty, H & Overington, J 2014, ''Big data' in pharmaceutical science: challenges and opportunities' Future Medicinal Chemistry, vol 6, no. 8, pp. 857-64. DOI: 10.4155/fmc.14.45

more...

Sandtner, W, Stockner, T, Hasenhuetl, PS, Partilla, JS, Seddik, A, Zhang, Y-W, Cao, J, Holy, M, Steinkellner, T, Rudnick, G, Baumann, MH, Ecker, GF, Newman, AH & Sitte, HH 2016, 'Binding Mode Selection Determines the Action of Ecstasy Homologs at Monoamine Transporters' Molecular Pharmacology, vol 89, no. 1, pp. 165-175. DOI: 10.1124/mol.115.101394

more...

Zdrazil, B & Ecker, G 2009, Cancer Drug Resistance – Targets and therapies. in Burgers Medicinal Chemistry - Drug Discovery and Development. Unknown publisher.

more...

Tasanor, O, Ernst, M, Thriemer, K, Ecker, G, Nödl, H & Chiba, P 2007, 'Characterization of a novel class of antimalarials and its applicability to plasmodial target identification' Wiener Medizinische Wochenschrift, vol 119, no. SUPPL. 3, pp. 83-87.

more...

Tasanor, O, Ernst, M, Thriemer, K, Ecker, GF, Noedl, H & Chiba, P 2009, 'Characterization of a novel class of antimalarials and its applicability to plasmodial target identification. (vol 119, pg 83, 2007)' Wiener Klinische Wochenschrift: The Central European Journal of Medicine, vol 121, pp. III-III.

more...

Thai, K-M & Ecker, GF 2008, 'Classification models for hERG inhibitors by counter-propagation neural networks' Chemical Biology and Drug Design, vol 72, no. 4, pp. 279-289. DOI: 10.1111/j.1747-0285.2008.00705.x

more...

Thai, KM & Ecker, G 2008, 'Classification models for hERG inhibitors by Counter-Propagation Neural Networks' Chemical Biology and Drug Design, no. 72, pp. 279-289.

more...

Jurik, A, Reicherstorfer, R, Zdrazil, B & Ecker, GF 2013, 'Classification of High-Activity Tiagabine Analogs by Binary QSAR Modeling' Molecular Informatics, vol 32, no. 5-6, pp. 415-419. DOI: 10.1002/minf.201300020

more...

Sugano, K, Kansy, M, Artursson, P, Avdeef, A, Bendels, S, Di, L, Ecker, GF, Faller, B, Fischer, H, Gerebtzoff, G, Lennernaes, H & Senner, F 2010, 'Coexistence of passive and carrier-mediated processes in drug transport' Nature Reviews. Drug Discovery, vol 9, no. 8, pp. 597-614. DOI: 10.1038/nrd3187

more...

Seddik, A, Geerke, DP, Stockner, T, Holy, M, Kudlacek, O, Cozzi, NV, Ruoho, AE, Sitte, HH & Ecker, GF 2016, 'Combined Simulation and Mutation Studies to Elucidate Selectivity of Unsubstituted Amphetamine-like Cathinones at the Dopamine Transporter' Molecular Informatics. DOI: 10.1002/minf.201600094

more...

Demel, M, Janecek, A, Gansterer, W & Ecker, G 2009, 'Comparison of Contemporary Feature Selection Algorithms: Application to the Classification of ABC-Transporter Substrates' QSAR & Combinatorial Science, vol 28, no. 10, pp. 1087-1091. DOI: 10.1002/qsar.200860191

more...

Pinto, M, Digles, D & Ecker, GF 2014, 'Computational models for predicting the interaction with ABC transporters' Drug Discovery Today: Technologies, vol 12, pp. e69-77. DOI: 10.1016/j.ddtec.2014.03.007

more...

Ecker, GF, Stockner, T & Chiba, P 2008, 'Computational models for prediction of interactions with ABC-transporters' Drug Discovery Today, vol 13, no. 7-8, pp. 311-317.

more...

Aher, Y, Stampfel, G, Demel, M, Stockner, T, Gansterer, W & Ecker, G 2009, 'Condor@Univie – a Distributed System Web Portal for Rigid & Flexible Ligand-Protein Docking' Scientia Pharmaceutica. DOI: 10.3797/scipharm.oephg.21.PO-01

more...

Stockner, T, de Vries, SJ, Bonvin, AMJJ, Ecker, GF & Chiba, P 2009, 'Data-driven homology modelling of P-glycoprotein in the ATP-bound state indicates flexibility of the transmembrane domains' The FEBS Journal, vol 276, no. 4, pp. 964-972. DOI: 10.1111/j.1742-4658.2008.06832.x

more...

Ecker, G & Chiba, P 2001, Design and development of propafenone-type inhibitors of drug efflux pumps. in Unknown host publication title. Unknown publisher, pp. 121-137.

more...

Lauer, R, Bauer, R, Linz, B, Pittner, F, Peschek, G, Ecker, G, Friedl, P & Noe, C 2004, 'Development of an in vitro blood-brain barrier model based on immortalized porcine brain microvascular endothelial cells' Il Farmaco, vol 59, no. 2, pp. 133-137. DOI: 10.1016/j.farmac.2003.11.007

more...

Neudorfer, C, Shanab, K, Jurik, A, Schreiber, V, Neudorfer, C, Vraka, C, Schirmer, E, Holzer, W, Ecker, G, Mitterhauser, M, Wadsak, W & Spreitzer, H 2014, 'Development of potential selective and reversible pyrazoline based MAO-B inhibitors as MAO-B PET tracer precursors and reference substances for the early detection of Alzheimer's disease' Bioorganic & Medicinal Chemistry Letters, vol 24, no. 18, pp. 4490-4495. DOI: 10.1016/j.bmcl.2014.07.085

more...

Stockner, T, Jurik, A, Weissensteiner, R, Freissmuth, M, Ecker, G & Sitte, HH 2014, Development of Refined Homology Models: Adding the Missing Information to the Medically Relevant Neurotransmitter Transporters. in R Krämer & C Ziegler (eds), Membrane Transport Mechanism: 3D Structure and Beyond. vol. 17, Springer-Verlag Berlin-Heidelberg, pp. 99-120.

more...

Richter, L, de Graaf, C, Sieghart, W, Varagic, Z, Moerzinger, M, de Esch, IJP, Ecker, GF & Ernst, M 2012, 'Diazepam-bound GABA(A) receptor models identify new benzodiazepine binding-site ligands' Nature Chemical Biology, vol 8, no. 5, pp. 455-464. DOI: 10.1038/NCHEMBIO.917

more...

Stuppner, H, Ecker, G & Glasl-Tazreiter, S 2006, 'Diplomstudium versus Bakkalaureat' Österreichische Apothekerzeitung, vol 60, no. 8, pp. 397-399.

more...

Chichester, C, Digles, D, Siebes, R, Loizou, A, Groth, P & Harland, L 2015, 'Drug discovery FAQs: Workflows for answering multidomain drug discovery questions' Drug Discovery Today, vol 20, no. 4, pp. 399-405. DOI: 10.1016/j.drudis.2014.11.006

more...

Schöffmann, A, Wimmer, L, Goldmann, D, Khom, S, Hintersteiner, J, Baburin, I, Schwarz, T, Hintersteininger, M, Pakfeifer, P, Oufir, M, Hamburger, M, Erker, T, Ecker, GF, Mihovilovic, MD & Hering, S 2014, 'Efficient modulation of γ-aminobutyric acid type A receptors by piperine derivatives' Journal of Medicinal Chemistry, vol 57, no. 13, pp. 5602-5619. DOI: 10.1021/jm5002277

more...

Goldmann, D, Zdrazil, B, Digles, D & Ecker, GF 2017, 'Empowering pharmacoinformatics by linked life science data' Journal of Computer-Aided Molecular Design, vol 31, no. 3, pp. 319-328. DOI: 10.1007/s10822-016-9990-4

more...

Demel, M, Krämer, O, Ettmayer, P, Haaksma, E & Ecker, G 2010, 'Ensemble Rule-based classification of substrates of the human ABC-transporter ABCB1 using simple physicochemical descriptors' Molecular Informatics, vol 29, no. 3, pp. 233-242. DOI: 10.1002/minf.200900079

more...

Ecker, G, Schaper, K-J & Chiba, P 1997, 'Estimation of chemosensitising activity of modulators of multidrug resistance via combined simultaneous analysis of sigmoidal dose-response curves' Journal of Pharmacy and Pharmacology : JPP; an international journal of pharmaceutical science, vol 49, pp. 305-309.

more...