Consultation hours: Wed 14:00 - 15:00, 2E405 or online, registration per E-mail at latest till Friday the week before
Prediction of Toxicity - let's use Fingerprints
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
In silica prediction of toxicity - from QSAR models to biological fingerprinting
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
Predicting chemicals' Molecular Initiating Events (MIEs) based on protein structure
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
Structure-based prediction of molecular initiating events - where are we?
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
Transporter Informatics and Computational Toxicology - from QSAR to Machine Learning and beyond
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
Wie lassen sich Elternschaft und Wissenschaft vereinbaren?
Veronika Wöhrer (Speaker), Gerhard Ecker (Speaker), Therese Garstenauer (Speaker), Benjamin Herr (Speaker) & Alice Leal (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
Arzneistoffentwicklung in Zeiten personalisierter Medizin
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
In silico Toxicology - from prediction of transporter interaction profiles to toxicological read across and beyond
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
The OMICS approach - the buzz that makes the world go round
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
Upsampling of Molecules to create datasets large enough for Deep learning in toxicity prediction
Jennifer Hemmerich (Speaker), Ece Asilar (Contributor) & Gerhard Ecker (Contributor)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
DEEPHUNT: HEPATOTOXICITY USING NEURAL NETWORKS.
Ece Asilar (Speaker), Jennifer Hemmerich (Contributor) & Gerhard Ecker (Contributor)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
Exploring the use of neural networks for prediction of toxicities
Jennifer Hemmerich (Speaker), Ece Asilar (Contributor) & Gerhard Ecker (Contributor)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
Predicting ligand residence time - it's all about how long you stay
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
Leveraging integrated life science data – the power of workflows
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
In silico Toxicology - from prediction of transporter interaction profiles to toxicological read across and beyond
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
Linking open data - from transporter interaction profiles to toxicity prediction
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
Predicting drug residence time - its all about how long you stay
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
Open PHACTS - Exploiting semantically integrated life science data for transporter profiling
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
Leveraging linked open data - from transporter interaction profiling to toxicity prediction and beyond
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
Innovative Medicines Initiative - From semantic data integration to risk assessment
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
Leveraging open data for development of ABC-transporter inhibitors
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
Leveraging linked open data - from transporter profiling to toxicity prediction and beyond
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
Leveraging linked open data - from transporter interaction profiling to toxicity prediction and beyond
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
Exploiting semantically integrated life science data - from transporter profiling to toxicity prediction
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
The power of open data - linking transporter interaction profiles to in vivo toxicity
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
Leveraging linked open data - from transporter interaction profiles to toxicity prediction
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Science to Science
Open Innovation in the Age of Big Data
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Exploiting Linked Open Data - the Power of Workflows
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Quantitative structure-kinetics relationships - can we predict on and off-kinetics?
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
the Open PHACTS Discovery Platform - Semantic data integration in Pharmacoinformatics
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
It's all about integration - from docking to structure-based classification and prediction of side effects
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
The Open PHACTS Discovery Platform - Semantic data integration for medicinal chemists
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Open PHACTS - the use of open data for in silico models
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Exploiting integrated open data in drug discovery
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
It's all about integration - From docking poses to structure-based classification and prediction of side effects
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Open PHACTS - Building an open pharmacological space
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Experimental data guided docking for elucidating the molecular basis of drug-transporter interaction
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Experimental data guided docking allows to elucidate the molecular basis of drug-transporter interaction
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Arzneistoffdesign am computer - Spielerei oder Wissenschaft
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Computational Drug Design
Gerhard Ecker (Keynote speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Integrated approaches - from docking poses to prediction of side effects
Gerhard Ecker (Keynote speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Exploiting open data - a new era in pharmacoinformatics
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Open PHACTS - a novel platform for integrated data-driven drug discovery
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Arzneistoffentwicklung am Computer - Fact or Fiction?
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Pharmacoinformatics - from data integration to in silico screening
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
The medicinal chemistry of drug transport – knowledge based ligand design.
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Ligand efficiency and lipophilic efficiency – versatile parameters for the design of inhibitors of transmembrane transporters?
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
The molecular basis of drug-transporter interaction - science or fiction?
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Arzneistofftransporter und ihre Rolle in der Pharmaforschung
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Drug Transporters – Structure, Function, and Modulation
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Knowledge driven ligand design – ligand-based design meets protein structures
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Ligand- and structure-based approaches for targeting drug transporter
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Experimental data guided ligand docking - a versatile approach for elucidating the molecular basis of drug/transporter interactions
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Computational drug design - where are we and where to go
Gerhard Ecker (Keynote speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Prediction of ADMET – from rules to networks
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
The medicinal chemistry of drug transporters
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
In silico studies for prediction of substrates and inhibitors of P-glycoprotein.
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
The medicinal chemistry of P-glycoprotein – ligand- and target-based studies
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
In silico models for classification of ABC-transporter substrates to improve ADMET profiling
Gerhard Ecker (Contributor)
Activity: Talks and presentations › Talk or oral contribution › Other
Pharmacoinformatics – combining experimental pharmaceutical sciences with in silico methods
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Predicting substrate properties for ABC-Transporter - Safety Sciences on the molecular level
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
SIBAR descriptors and support vector machines for ABCB1 substrate prediction
Gerhard Ecker (Contributor)
Activity: Talks and presentations › Talk or oral contribution › Other
Predicting Ligands of ABC-transporter - a long way to go
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Predicting Interaction with ABC-Transporters involved in ADME
Gerhard Ecker (Keynote speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Safety Sciences in silico - Analyse unerwünschter Wirkungen durch molekulare Modellierung
Gerhard Ecker (Keynote speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Optimising ligands for promiscuous targets - a case study for P-glycoprotein inhibitors
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Prediction of ligands of promiscuous targets - safety sciences on the molecular level
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Optimizing Ligands for Promiscuous Targets - A Case Study for P-glycoprotein Inhibitors
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Pharmacoinformatic approaches to target polyspecific proteins
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Use your brain - artificial neural networks in drug discovery
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
EUROPIN - A European Pharmacoinformatics Initative
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
P-glycoprotein - from inhibitor design to substrate prediction
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Prediction of substrate properties for ABC Drug-Transporter: The challenge continues
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Classification models for hERG inhibitors by counter-propagation neural networks
Gerhard Ecker (Contributor)
Activity: Talks and presentations › Talk or oral contribution › Other
Pharmacoinformatic approaches to target P-glycoprotein - from inhibitor design to substrate prediction
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
EUROPIN - A European Pharmacoinformatics Initative
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Predicting ligands for P-glycoprotein - safety sciences on the molecular level
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Computermodels for predicting P-glycoprotein substrates - can we guide the lead optimisation process?
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Linking chemical space to biological space - challenges for high-throughput computing
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Use your brain - artificial neural networks in drug design
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Polyspecific proteins - safety sciences on the molecular level
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
P-glycoprotein - design of inhibitors and prediction of substrates
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Vortrag auf Kongress: Recent developments in physics of fundamental interactions
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Multispecificity of drug transporter - probing inhibitor selectivity for the human drug efflux transporter ABCB1 and ABCG2
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Chemigenomics and Drug Discovery
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
P-glycoprotein - from target to antitarget
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Predicting ligands for ABC-transporter - structure-based vs ligand-based approaches
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Polyspecific proteins - a challenge in pharmacoinformatics
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Comparative Analysis of two Different Classifiers for Predicting P-glycoprotein Substrates
Gerhard Ecker (Contributor)
Activity: Talks and presentations › Talk or oral contribution › Other
Machine learning methods for classification and hit identification
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Role of structural models of P-glycoprotein - the prediction of actively transported small molecules
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Von Penicillin bis Viagra : Arzneistoffentwicklung gestern - heute - morgen
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Von Penicillin bis Viagra : Arzneistoffentwicklung gestern - heute - morgen
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
In silico methods for hit identification and prediction of biological activities
Gerhard Ecker (Speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Drug efflux pumps - From target to antitarget
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
MDR - Multiple Drug Resistance
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Pharmacoinformatic approaches to target the molecular basis of polyspecificity
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
ABC-transporter as antitargets
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
In silico methods for prediction of P-glycoprotein substrates
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Non-linear methods and machine learning in drug discovery
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
In vitro and in silico models for prediction of P-glycoprotein substrates
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
A flow based hollow-fiber blood-brain barrier in vitro model with immortalised cell line PBMEC/C1-2
Gerhard Ecker (Contributor)
Activity: Talks and presentations › Talk or oral contribution › Other
P-glycoprotein - From target to antitarget
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Pharmacoinformatic approaches to target polyspecific proteins
Gerhard Ecker (Invited speaker)
Activity: Talks and presentations › Talk or oral contribution › Other
Add medical genetic solutions to RESOLUTE
Ecker, G., Dangl, A., Colas, C., Huang, J., Digles, D. & Schwarzenböck, M.
1/06/21 → 31/05/23
Project: Research funding
RISK-HUNT3R: RISK assessment of chemicals integrating HUman centric Next generation Testing strategies promoting the 3Rs
Ecker, G., Dangl, A. & Schwarzenböck, M.
1/06/21 → 31/05/26
Project: Research funding
ReSOLUTE: Research Empowerment on Solute Carriers
Ecker, G., Dangl, A., Digles, D., Colas, C. & Schwarzenböck, M.
1/07/18 → 31/12/23
Project: Research funding
eTRANSAFE: Enhancing TRANslational SAFEty Assessment through Integrative Knowledge Management
Ecker, G., Dangl, A., Hemmerich, J., Smajic, A., Grandits, M., Kaiser, F. & Schwarzenböck, M.
1/09/17 → 28/02/23
Project: Research funding
TransQST: Translational quantitative systems toxicology to improve the understanding of the safety of medicines
Ecker, G., Grandits, M., Dangl, A., Füzi, B. & Schwarzenböck, M.
1/01/17 → 30/06/22
Project: Research funding
EU-ToxRisk: EU-ToxRisk
Ecker, G., Grandits, M., Dangl, A., Zdrazil, B., Jain, S. & Schwarzenböck, M.
1/01/16 → 31/12/21
Project: Research funding
Molecular Drug Targets
Hering, S., Ecker, G., Maulide, N., Weinzinger, A. & Gonzalez Herrero, L.
1/12/10 → 31/12/22
Project: Research funding
Department of Pharmaceutical Sciences
Josef-Holaubek-Platz 2 (UZA II)
1090 Wien
Room: 2E405
T: +43-1-4277-55110