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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.
Publications
Showing entries 1 - 5 out of 312
Li, E, Boujeddaine, N, Houtman, MJC, Maas, Sluijter, , Ecker, G, Weinzinger, A, van Ham, W & van der Heyden, M 2024, 'Development of new Kir2.1 channel openers from propafenone analogues', British Journal of Pharmacology. <https://bpspubs.onlinelibrary.wiley.com/doi/10.1111/bph.17377>
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
Granulo, N, Sosnin, S, Digles, D & Ecker, GF 2024, 'The macrocycle inhibitor landscape of SLC‐transporter', Molecular Informatics, vol. 43, no. 5, e202300287. https://doi.org/10.1002/minf.202300287
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
Showing entries 191 - 195 out of 202
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