Cancer-Associated Mutations of the Adenosine A2A Receptor Have Diverse Influences on Ligand Binding and Receptor Functions
Feng, Chenlin, Wang, Xuesong, Jespers, Willem, Liu, Rongfang, Zamarbide Losada, Sofía Denise, Gorostiola González, Marina, van Westen, Gerard J. P., Danen, Erik H. J., Heitman, Laura H.
Published in Molecules (Basel, Switzerland) (22.07.2022)
Published in Molecules (Basel, Switzerland) (22.07.2022)
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Journal Article
Molecular insights into disease-associated glutamate transporter (EAAT1 / SLC1A3 ) variants using in silico and in vitro approaches
Gorostiola González, Marina, Sijben, Hubert J, Dall' Acqua, Laura, Liu, Rongfang, IJzerman, Adriaan P, Heitman, Laura H, van Westen, Gerard J P
Published in Frontiers in molecular biosciences (2023)
Published in Frontiers in molecular biosciences (2023)
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Journal Article
Computational Characterization of Membrane Proteins as Anticancer Targets: Current Challenges and Opportunities
Gorostiola González, Marina, Rakers, Pepijn R J, Jespers, Willem, IJzerman, Adriaan P, Heitman, Laura H, van Westen, Gerard J P
Published in International journal of molecular sciences (01.04.2024)
Published in International journal of molecular sciences (01.04.2024)
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Journal Article
Exploring novel dilazep derivatives as hENT1 inhibitors and potentially covalent molecular tools
Dilweg, Majlen A, Gorostiola González, Marina, de Ruiter, Martijn D, Meijboom, Nadine J, van Veldhoven, Jacobus P D, Liu, Rongfang, Jespers, Willem, van Westen, Gerard J P, Heitman, Laura H, IJzerman, Adriaan P, van der Es, Daan
Published in Purinergic signalling (15.06.2024)
Published in Purinergic signalling (15.06.2024)
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Journal Article
Structural Insights into the Mechanisms of Action of Functionally Distinct Classes of Chikungunya Virus Nonstructural Protein 1 Inhibitors
Kovacikova, Kristina, Gorostiola González, Marina, Jones, Rhian, Reguera, Juan, Gigante, Alba, Pérez-Pérez, María-Jesús, Pürstinger, Gerhard, Moesslacher, Julia, Langer, Thierry, Jeong, Lak Shin, Delang, Leen, Neyts, Johan, Snijder, Eric J, van Westen, Gerard J P, van Hemert, Martijn J
Published in Antimicrobial agents and chemotherapy (17.06.2021)
Published in Antimicrobial agents and chemotherapy (17.06.2021)
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Journal Article
Successive Statistical and Structure-Based Modeling to Identify Chemically Novel Kinase Inhibitors
Burggraaff, Lindsey, Lenselink, Eelke B, Jespers, Willem, van Engelen, Jesper, Bongers, Brandon J, González, Marina Gorostiola, Liu, Rongfang, Hoos, Holger H, van Vlijmen, Herman W. T, IJzerman, Adriaan P, van Westen, Gerard J. P
Published in Journal of chemical information and modeling (28.09.2020)
Published in Journal of chemical information and modeling (28.09.2020)
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Journal Article
Still in Search for an EAAT Activator: GT949 Does Not Activate EAAT2, nor EAAT3 in Impedance and Radioligand Uptake Assays
van Veggel, Lieve, Mocking, Tamara A.M., Sijben, Hubert J., Liu, Rongfang, Gorostiola González, Marina, Dilweg, Majlen A., Royakkers, Jeroen, Li, Anna, Kumar, Vijay, Dong, Yin Yao, Bullock, Alex, Sauer, David B., Diliën, Hanne, van Westen, Gerard J.P., Schreiber, Rudy, Heitman, Laura H., Vanmierlo, Tim
Published in ACS chemical neuroscience (03.04.2024)
Published in ACS chemical neuroscience (03.04.2024)
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Journal Article
3DDPDs: describing protein dynamics for proteochemometric bioactivity prediction. A case for (mutant) G protein-coupled receptors
Gorostiola González, Marina, van den Broek, Remco L., Braun, Thomas G. M., Chatzopoulou, Magdalini, Jespers, Willem, IJzerman, Adriaan P., Heitman, Laura H., van Westen, Gerard J. P.
Published in Journal of cheminformatics (28.08.2023)
Published in Journal of cheminformatics (28.08.2023)
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Journal Article
The effect of cancer-associated mutations on ligand binding and receptor function – A case for the 5-HT2C receptor
Feng, Chenlin, Liu, Rongfang, Brooks, Reno, Wang, Xuesong, Jespers, Willem, Gorostiola González, Marina, Westen, Gerard J.P. van, Danen, Erik H.J., Heitman, Laura H.
Published in European journal of pharmacology (15.12.2024)
Published in European journal of pharmacology (15.12.2024)
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Journal Article
The Effect of Cancer-Associated Mutations on Ligand Binding and Receptor Function - A Case for the 5-HT 2C Receptor
Feng, Chenlin, Liu, Rongfang, Brooks, Reno, Wang, Xuesong, Jespers, Willem, Gorostiola González, Marina, Westen, Gerard J P van, Danen, Erik H J, Heitman, Laura H
Published in European journal of pharmacology (29.10.2024)
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Published in European journal of pharmacology (29.10.2024)
Journal Article
Artificial intelligence for natural product drug discovery
Mullowney, Michael W., Duncan, Katherine R., Elsayed, Somayah S., Garg, Neha, van der Hooft, Justin J. J., Martin, Nathaniel I., Meijer, David, Terlouw, Barbara R., Biermann, Friederike, Blin, Kai, Durairaj, Janani, Gorostiola González, Marina, Helfrich, Eric J. N., Huber, Florian, Leopold-Messer, Stefan, Rajan, Kohulan, de Rond, Tristan, van Santen, Jeffrey A., Sorokina, Maria, Balunas, Marcy J., Beniddir, Mehdi A., van Bergeijk, Doris A., Carroll, Laura M., Clark, Chase M., Clevert, Djork-Arné, Dejong, Chris A., Du, Chao, Ferrinho, Scarlet, Grisoni, Francesca, Hofstetter, Albert, Jespers, Willem, Kalinina, Olga V., Kautsar, Satria A., Kim, Hyunwoo, Leao, Tiago F., Masschelein, Joleen, Rees, Evan R., Reher, Raphael, Reker, Daniel, Schwaller, Philippe, Segler, Marwin, Skinnider, Michael A., Walker, Allison S., Willighagen, Egon L., Zdrazil, Barbara, Ziemert, Nadine, Goss, Rebecca J. M., Guyomard, Pierre, Volkamer, Andrea, Gerwick, William H., Kim, Hyun Uk, Müller, Rolf, van Wezel, Gilles P., van Westen, Gerard J. P., Hirsch, Anna K. H., Linington, Roger G., Robinson, Serina L., Medema, Marnix H.
Published in Nature reviews. Drug discovery (01.11.2023)
Published in Nature reviews. Drug discovery (01.11.2023)
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Journal Article
PREDICCIÓN «IN SILICO» DE LA ABSORCIÓN DE FÁRMACOS EN PACIENTES CELIACOS
González, Marina Gorostiola, Sánchez, María José García, Buelga, María Dolores Santos
Published in FarmaJournal (01.02.2018)
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Published in FarmaJournal (01.02.2018)
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