Search Results - "IJzerman, Adriaan"

Drug–Target Association Kinetics in Drug Discovery by IJzerman, Adriaan P., Guo, Dong

“…The important role of ligand–receptor binding kinetics in drug design and discovery is increasingly recognized by the drug research community. Over the past…”
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Kinetic Aspects of the Interaction between Ligand and G Protein-Coupled Receptor: The Case of the Adenosine Receptors by Guo, Dong, Heitman, Laura H, IJzerman, Adriaan P

“…Ligand–receptor binding kinetics is an emerging topic in the drug research community. Over the past years, medicinal chemistry approaches from a kinetic…”
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International Union of Basic and Clinical Pharmacology. CXII: Adenosine Receptors: A Further Update by IJzerman, Adriaan P, Jacobson, Kenneth A, Müller, Christa E, Cronstein, Bruce N, Cunha, Rodrigo A

“…Our previous International Union of Basic and Clinical Pharmacology report on the nomenclature and classification of adenosine receptors (2011) contained a…”
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The translational value of ligand‐receptor binding kinetics in drug discovery by Liu, Hongli, Zhang, Haoran, IJzerman, Adriaan P., Guo, Dong

“…The translation of in vitro potency of a candidate drug, as determined by traditional pharmacology metrics (such as EC50/IC50 and KD/Ki values), to in vivo…”
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Structural Basis for Allosteric Regulation of GPCRs by Sodium Ions by Liu, Wei, Chun, Eugene, Thompson, Aaron A., Chubukov, Pavel, Xu, Fei, Katritch, Vsevolod, Han, Gye Won, Roth, Christopher B., Heitman, Laura H., IJzerman, Adriaan P., Cherezov, Vadim, Stevens, Raymond C.

“…Pharmacological responses of G protein-coupled receptors (GPCRs) can be fine-tuned by allosteric modulators. Structural studies of such effects have been…”
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International Union of Basic and Clinical Pharmacology. LXXXI. Nomenclature and classification of adenosine receptors--an update by Fredholm, Bertil B, IJzerman, Adriaan P, Jacobson, Kenneth A, Linden, Joel, Müller, Christa E

“…In the 10 years since our previous International Union of Basic and Clinical Pharmacology report on the nomenclature and classification of adenosine receptors,…”
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Medicinal chemistry of P2 and adenosine receptors: Common scaffolds adapted for multiple targets by Jacobson, Kenneth A., IJzerman, Adriaan P., Müller, Christa E.

“…[Display omitted] Prof. Geoffrey Burnstock originated the concept of purinergic signaling. He demonstrated the interactions and biological roles of ionotropic…”
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Affinity, binding kinetics and functional characterization of draflazine analogues for human equilibrative nucleoside transporter 1 (SLC29A1) by Vlachodimou, Anna, Konstantinopoulou, Konstantina, IJzerman, Adriaan P., Heitman, Laura H.

“…[Display omitted] In the last decade it has been recapitulated that receptor-ligand binding kinetics is a relevant additional parameter in drug discovery to…”
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Functional efficacy of adenosine A 2A receptor agonists is positively correlated to their receptor residence time by Guo, Dong, Mulder‐Krieger, Thea, IJzerman, Adriaan P, Heitman, Laura H

“…BACKGROUND AND PURPOSE The adenosine A 2A receptor belongs to the superfamily of GPCRs and is a promising therapeutic target. Traditionally, the discovery of…”
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Computational Approaches for De Novo Drug Design: Past, Present, and Future by Liu, Xuhan, IJzerman, Adriaan P, van Westen, Gerard J P

“…Drug discovery is time- and resource-consuming. To this end, computational approaches that are applied in de novo drug design play an important role to improve…”
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Allosteric modulation of G protein‐coupled receptors by amiloride and its derivatives. Perspectives for drug discovery? by Massink, Arnault, Amelia, Tasia, Karamychev, Alex, IJzerman, Adriaan P.

“…The function of G protein‐coupled receptors (GPCRs) can be modulated by compounds that bind to other sites than the endogenous orthosteric binding site,…”
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Controlling the Dissociation of Ligands from the Adenosine A2A Receptor through Modulation of Salt Bridge Strength by Segala, Elena, Guo, Dong, Cheng, Robert K. Y, Bortolato, Andrea, Deflorian, Francesca, Doré, Andrew S, Errey, James C, Heitman, Laura H, IJzerman, Adriaan P, Marshall, Fiona H, Cooke, Robert M

“…The association and dissociation kinetics of ligands binding to proteins vary considerably, but the mechanisms behind this variability are poorly understood,…”
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Beyond the hype: deep neural networks outperform established methods using a ChEMBL bioactivity benchmark set by Lenselink, Eelke B., ten Dijke, Niels, Bongers, Brandon, Papadatos, George, van Vlijmen, Herman W. T., Kowalczyk, Wojtek, IJzerman, Adriaan P., van Westen, Gerard J. P.

“…The increase of publicly available bioactivity data in recent years has fueled and catalyzed research in chemogenomics, data mining, and modeling approaches…”
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Kinetics for Drug Discovery: an industry-driven effort to target drug residence time by Schuetz, Doris A., de Witte, Wilhelmus Egbertus Arnout, Wong, Yin Cheong, Knasmueller, Bernhard, Richter, Lars, Kokh, Daria B., Sadiq, S. Kashif, Bosma, Reggie, Nederpelt, Indira, Heitman, Laura H., Segala, Elena, Amaral, Marta, Guo, Dong, Andres, Dorothee, Georgi, Victoria, Stoddart, Leigh A., Hill, Steve, Cooke, Robert M., De Graaf, Chris, Leurs, Rob, Frech, Matthias, Wade, Rebecca C., de Lange, Elizabeth Cunera Maria, IJzerman, Adriaan P., Müller-Fahrnow, Anke, Ecker, Gerhard F.

“…•A public–private partnership targets drug-binding kinetics in a multilevel approach.•New experimental approaches for measuring drug residence time are…”
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Structure of CC chemokine receptor 2 with orthosteric and allosteric antagonists by Zheng, Yi, Qin, Ling, Zacarías, Natalia V. Ortiz, de Vries, Henk, Han, Gye Won, Gustavsson, Martin, Dabros, Marta, Zhao, Chunxia, Cherney, Robert J., Carter, Percy, Stamos, Dean, Abagyan, Ruben, Cherezov, Vadim, Stevens, Raymond C., IJzerman, Adriaan P., Heitman, Laura H., Tebben, Andrew, Kufareva, Irina, Handel, Tracy M.

“…The crystal structure of CCR2 chemokine receptor in a complex with two different antagonists—one orthosteric the other allosteric—which functionally cooperate…”
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Advances and Challenges in Computational Target Prediction by Sydow, Dominique, Burggraaff, Lindsey, Szengel, Angelika, van Vlijmen, Herman W. T, IJzerman, Adriaan P, van Westen, Gerard J. P, Volkamer, Andrea

“…Target deconvolution is a vital initial step in preclinical drug development to determine research focus and strategy. In this respect, computational target…”
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Label-free detection of transporter activity via GPCR signalling in living cells: A case for SLC29A1, the equilibrative nucleoside transporter 1 by Vlachodimou, Anna, IJzerman, Adriaan P., Heitman, Laura H.

“…Transporters are important therapeutic but yet understudied targets due to lack of available assays. Here we describe a novel label-free, whole-cell method for…”
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International Union of Basic and Clinical Pharmacology. LXXXII: Nomenclature and Classification of Hydroxy-carboxylic Acid Receptors (GPR81, GPR109A, and GPR109B) by Offermanns, Stefan, Colletti, Steven L, Lovenberg, Timothy W, Semple, Graeme, Wise, Alan, IJzerman, Adriaan P

“…The G-protein-coupled receptors GPR81, GPR109A, and GPR109B share significant sequence homology and form a small group of receptors, each of which is encoded…”
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Functional efficacy of adenosine A2A receptor agonists is positively correlated to their receptor residence time by Guo, Dong, Mulder‐Krieger, Thea, IJzerman, Adriaan P, Heitman, Laura H

“…BACKGROUND AND PURPOSE The adenosine A2A receptor belongs to the superfamily of GPCRs and is a promising therapeutic target. Traditionally, the discovery of…”
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2.6 Angstrom Crystal Structure of a Human A₂A Adenosine Receptor Bound to an Antagonist by Jaakola, Veli-Pekka, Griffith, Mark T, Hanson, Michael A, Cherezov, Vadim, Chien, Ellen Y.T, Lane, J. Robert, IJzerman, Adriaan P, Stevens, Raymond C

“…The adenosine class of heterotrimeric guanine nucleotide-binding protein (G protein)-coupled receptors (GPCRs) mediates the important role of extracellular…”
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