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Barbara Zdrazil
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Adverse outcome pathways: opportunities, limitations and open questions
M Leist, A Ghallab, R Graepel, R Marchan, R Hassan, SH Bennekou, ...
Archives of Toxicology 91, 3477-3505, 2017
3102017
The N terminus of monoamine transporters is a lever required for the action of amphetamines
S Sucic, S Dallinger, B Zdrazil, R Weissensteiner, TN Jřrgensen, M Holy, ...
Journal of Biological Chemistry 285 (14), 10924-10938, 2010
1502010
Towards grouping concepts based on new approach methodologies in chemical hazard assessment: the read-across approach of the EU-ToxRisk project
SE Escher, H Kamp, SH Bennekou, A Bitsch, C Fisher, R Graepel, ...
Archives of toxicology 93, 3643-3667, 2019
942019
Scientific competency questions as the basis for semantically enriched open pharmacological space development
K Azzaoui, E Jacoby, S Senger, EC Rodríguez, M Loza, B Zdrazil, M Pinto, ...
Drug Discovery Today 18 (17-18), 843-852, 2013
612013
The rise and fall of a scaffold: a trend analysis of scaffolds in the medicinal chemistry literature
B Zdrazil, R Guha
Journal of Medicinal Chemistry 61 (11), 4688-4703, 2017
472017
The application of the open pharmacological concepts triple store (open PHACTS) to support drug discovery research
J Ratnam, B Zdrazil, D Digles, E Cuadrado-Rodriguez, JM Neefs, ...
PLoS One 9 (12), e115460, 2014
352014
A binding mode hypothesis of tiagabine confirms liothyronine effect on γ-aminobutyric acid transporter 1 (GAT1)
A Jurik, B Zdrazil, M Holy, T Stockner, HH Sitte, GF Ecker
Journal of medicinal chemistry 58 (5), 2149-2158, 2015
332015
Moving targets in drug discovery
B Zdrazil, L Richter, N Brown, R Guha
Scientific reports 10 (1), 20213, 2020
322020
Selectivity profiling of BCRP versus P-gp inhibition: from automated collection of polypharmacology data to multi-label learning
F Montanari, B Zdrazil, D Digles, GF Ecker
Journal of cheminformatics 8 (1), 1-13, 2016
322016
Annotating human P‐glycoprotein bioassay data
B Zdrazil, M Pinto, P Vasanthanathan, AJ Williams, LZ Balderud, ...
Molecular Informatics 31 (8), 599-609, 2012
322012
Differences in metformin and thiamine uptake between human and mouse organic cation transporter 1: Structural determinants and potential consequences for intrahepatic …
MJ Meyer, A Tuerkova, S Römer, C Wenzel, T Seitz, J Gaedcke, S Oswald, ...
Drug Metabolism and Disposition 48 (12), 1380-1392, 2020
282020
Opioids as substrates and inhibitors of the genetically highly variable organic cation transporter OCT1
MJ Meyer, VE Neumann, HR Friesacher, B Zdrazil, J Brockmöller, ...
Journal of medicinal chemistry 62 (21), 9890-9905, 2019
232019
Identification of anticancer OATP2B1 substrates by an in vitro triple-fluorescence-based cytotoxicity screen
T Windt, S Tóth, I Patik, J Sessler, N Kucsma, Á Szepesi, B Zdrazil, ...
Archives of toxicology 93 (4), 953-964, 2019
232019
Exploiting open data: a new era in pharmacoinformatics
D Goldmann, F Montanari, L Richter, B Zdrazil, GF Ecker
Future medicinal chemistry 6 (5), 503-514, 2014
232014
A ligand-based computational drug repurposing pipeline using KNIME and Programmatic Data Access: case studies for rare diseases and COVID-19
A Tuerkova, B Zdrazil
Journal of cheminformatics 12 (1), 1-20, 2020
212020
Current advances in studying clinically relevant transporters of the solute carrier (SLC) family by connecting computational modeling and data science
A Türková, B Zdrazil
Computational and Structural Biotechnology Journal 17, 390-405, 2019
202019
Embl’s European Bioinformatics Institute (embl-ebi) in 2022
M Thakur, A Bateman, C Brooksbank, M Freeberg, M Harrison, M Hartley, ...
Nucleic Acids Research 51 (D1), D9-D17, 2023
172023
Open PHACTS computational protocols for in silico target validation of cellular phenotypic screens: knowing the knowns
D Digles, B Zdrazil, JM Neefs, H Van Vlijmen, C Herhaus, A Caracoti, ...
Medchemcomm 7 (6), 1237-1244, 2016
172016
Probing the selectivity of monoamine transporter substrates by means of molecular modeling
A Seddik, M Holy, R Weissensteiner, B Zdrazil, HH Sitte, GF Ecker
Molecular informatics 32 (5-6), 409, 2013
172013
Similarity‐Based Descriptors (SIBAR) as Tool for QSAR Studies on P‐Glycoprotein Inhibitors: Influence of the Reference Set
B Zdrazil, D Kaiser, S Kopp, P Chiba, GF Ecker
QSAR & Combinatorial Science 26 (5), 669-678, 2007
172007
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Articles 1–20