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Head of Group
Director of Corporate Program

His main research interests are ligand- and structure-based drug design with focus on transmembrane transport proteins, prediction of on- and off-kinetics, as well as semantic data integration.

Contact Hours for Students

  • Wednesday 14:00 - 15:00
  • Room 2E405 (or online) 
  • only after appointment via E-Mail latest on Friday before
Publications

Showing entries 1 - 5 out of 312
Digles, D, Ingles-Prieto, A, Dvorak, V, Mocking, TAM, Goldmann, U, Garofoli, A, Homan, EJ, Di Silvio, A, Azzollini, L, Sassone, F, Fogazza, M, Bärenz, F, Pommereau, A, Zuschlag, Y, Ooms, JF, Tranberg-Jensen, J, Hansen, JS, Stanka, J, Sijben, HJ, Batoulis, H, Bender, E, Martini, R, IJzerman, AP, Sauer, DB, Heitman, LH, Manolova, V, Reinhardt, J, Ehrmann, A, Leippe, P, Ecker, GF, Huber, KVM, Licher, T, Scarabottolo, L, Wiedmer, T & Superti-Furga, G 2024, 'Advancing drug discovery through assay development: a survey of tool compounds within the human solute carrier superfamily', Frontiers in Pharmacology, vol. 15, 1401599. https://doi.org/10.3389/fphar.2024.1401599

Huang, J, Osthushenrich, T, MacNamara, A, Mälarstig, A, Brocchetti, S, Bradberry, S, Scarabottolo, L, Ferrada, E, Sosnin, S, Digles, D, Superti-Furga, G & Ecker, GF 2024, 'ProteoMutaMetrics: machine learning approaches for solute carrier family 6 mutation pathogenicity prediction', Rsc advances, vol. 14, no. 19, 00748, pp. 13083-13094. https://doi.org/10.1039/d4ra00748d

Ferrada, E, Wiedmer, T, Wang, WA, Frommelt, F, Steurer, B, Klimek, C, Lindinger, S, Osthushenrich, T, Garofoli, A, Brocchetti, S, Bradberry, S, Huang, J, MacNamara, A, Scarabottolo, L, Ecker, GF, Malarstig, A & Superti-Furga, G 2024, 'Experimental and Computational Analysis of Newly Identified Pathogenic Mutations in the Creatine Transporter SLC6A8', Journal of Molecular Biology, vol. 436, no. 2, 168383. https://doi.org/10.1016/j.jmb.2023.168383

Activities

HYDRAA - A tool to implement hydrophobic moments in structure activity relationships and molecular alignments

Gerhard Ecker
ESMEC - European School of Medicinal Chemistry
Summer/Winter school, Poster presentation
..2006 - ..2006

Molecular dynamics simulation studies of nucleotide free P-glycoprotein in a POPC bilayer

Karl Peter Wolschann , Anton Beyer , Gerhard Ecker , Reinhard Wohlfart , Peter Chiba , Thomas Stockner
19th International Symposium on Medicinal Chemistry
Conference, Poster presentation
..2006 - ..2006

Molecular similarity values as input vectors for QSAR studies of ABCB1 inhibitors

Gerhard Ecker , Jordi Mestres , Peter Chiba , Ferran Sanz
19th International Symposium on Medicinal Chemistry
Conference, Poster presentation
..2006 - ..2006

MsbA from Salmonella Typhimurium as template for a protein homology model of post-hydrolytic P-glycoprotein

Gerhard Ecker , Peter Chiba
19. Wissenschaftliche Tagung der Österreichischen Pharmazeutischen Gesellschaft, Innsbruck 2006
Conference, Poster presentation
..2006 - ..2006

Predictive models for P-glycoprotein substrates based on VSA-descriptors

Gerhard Ecker , Peter Chiba
231st American Chemical Society National Meeting
Conference, Poster presentation
..2006 - ..2006