| Screening and characterisation of antimicrobial properties of semisynthetic betulin derivatives S Haque, DA Nawrot, S Alakurtti, L Ghemtio, J Yli-Kauhaluoma, ... PLoS One 9 (7), e102696, 2014 | 86 | 2014 |
| Tamoxifen mechanically deactivates hepatic stellate cells via the G protein-coupled estrogen receptor E Cortes, D Lachowski, A Rice, SD Thorpe, B Robinson, G Yeldag, ... Oncogene 38 (16), 2910-2922, 2019 | 48 | 2019 |
| Structural isosteres of phosphate groups in the protein data bank Y Zhang, A Borrel, L Ghemtio, L Regad, G Boije af Gennäs, ... Journal of Chemical Information and Modeling 57 (3), 499-516, 2017 | 42 | 2017 |
| Applying linear and non-linear methods for parallel prediction of volume of distribution and fraction of unbound drug EM del Amo, L Ghemtio, H Xhaard, M Yliperttula, A Urtti, H Kidron PLoS One 8 (10), e74758, 2013 | 27 | 2013 |
| IDAAPM: integrated database of ADMET and adverse effects of predictive modeling based on FDA approved drug data A Legehar, H Xhaard, L Ghemtio Journal of Cheminformatics 8, 1-11, 2016 | 26 | 2016 |
| Exploring the structure–activity relationships of ABCC2 modulators using a screening approach G Wissel, P Kudryavtsev, L Ghemtio, P Tammela, P Wipf, M Yliperttula, ... Bioorganic & medicinal chemistry 23 (13), 3513-3525, 2015 | 26 | 2015 |
| Multiple-step virtual screening using VSM-G: overview and validation of fast geometrical matching enrichment A Beautrait, V Leroux, M Chavent, L Ghemtio, MD Devignes, ... Journal of molecular modeling 14, 135-148, 2008 | 25 | 2008 |
| Recent trends and applications in 3D virtual screening L Ghemtio, V I Perez-Nueno, V Leroux, Y Asses, M Souchet, L Mavridis, ... Combinatorial Chemistry & High Throughput Screening 15 (9), 749-769, 2012 | 19 | 2012 |
| Binding site interactions of modulators of breast cancer resistance protein, multidrug resistance-associated protein 2, and P-glycoprotein activity F Deng, L Ghemtio, E Grazhdankin, P Wipf, H Xhaard, H Kidron Molecular pharmaceutics 17 (7), 2398-2410, 2020 | 18 | 2020 |
| SVM classification and CoMSIA modeling of UGT1A6 interacting molecules L Ghemtio, A Soikkeli, M Yliperttula, J Hirvonen, M Finel, H Xhaard Journal of Chemical Information and Modeling 54 (4), 1011-1026, 2014 | 17 | 2014 |
| Installation of an aryl boronic acid function into the external section of N-aryl-oxazolidinones: Synthesis and antimicrobial evaluation CD Cruz, P Wrigstedt, K Moslova, V Iashin, H Mäkkylä, L Ghemtio, ... European Journal of Medicinal Chemistry 211, 113002, 2021 | 15 | 2021 |
| A structure-activity relationship study of ABCC2 inhibitors G Wissel, F Deng, P Kudryavtsev, L Ghemtio, P Wipf, H Xhaard, H Kidron European Journal of Pharmaceutical Sciences 103, 60-69, 2017 | 12 | 2017 |
| Comparison of three preprocessing filters efficiency in virtual screening: identification of new putative LXRβ regulators as a test case L Ghemtio, MD Devignes, M Smaïl-Tabbone, M Souchet, V Leroux, ... Journal of chemical information and modeling 50 (5), 701-715, 2010 | 12 | 2010 |
| Adenosine analogs bearing phosphate isosteres as human MDO1 ligands Y Zhang, M Jumppanen, MM Maksimainen, S Auno, Z Awol, L Ghemtio, ... Bioorganic & Medicinal Chemistry 26 (8), 1588-1597, 2018 | 10 | 2018 |
| CoMFA/CoMSIA and pharmacophore modelling as a powerful tools for efficient virtual screening: Application to anti-leishmanial betulin derivatives L Ghemtio, Y Zhang, H Xhaard Virtual Screen, 55-82, 2012 | 10 | 2012 |
| Predictive modeling of ocular pharmacokinetics and adverse effects L Ghemtio, H Xhaard, A Urtti, H Kidron Current pharmaceutical design 22 (46), 6928-6934, 2016 | 8 | 2016 |
| AICAR and compound C negatively modulate HCC-induced primary human hepatic stellate cell activation in vitro K Böttcher, L Longato, G Marrone, G Mazza, L Ghemtio, A Hall, TV Luong, ... American Journal of Physiology-Gastrointestinal and Liver Physiology 320 (4 …, 2021 | 7 | 2021 |
| Retrospective molecular docking study of WY-25105 ligand to β-secretase and bias of the three-dimensional structure flexibility L Ghemtio, N Muzet Journal of molecular modeling 19, 2971-2979, 2013 | 7 | 2013 |
| Integrated In Vitro–In Silico Screening Strategy for the Discovery of Antibacterial Compounds S Nybond, L Ghemtio, DA Nawrot, M Karp, H Xhaard, P Tammela Assay and drug development technologies 13 (1), 25-33, 2015 | 4 | 2015 |
| Predictive classification models and targets identification for betulin derivatives as Leishmania donovani inhibitors Y Zhang, H Xhaard, L Ghemtio Journal of Cheminformatics 10, 1-16, 2018 | 3 | 2018 |
