Items where Author is "Keserű, György Miklós"

Article

Szepesi Kovács, Dénes and Ábrányi-Balogh, Péter and Keserű, György Miklós (2024) Site-Selective Antibody Conjugation with Dibromopyrazines. BIOCONJUGATE CHEMISTRY, 35 (9).

Ábrányi-Balogh, Péter and Bajusz, Dávid and Keserű, György Miklós (2024) Mapping protein binding sites by photoreactive fragment pharmacophores. COMMUNICATIONS CHEMISTRY, 7. No.-168. ISSN 2399-3669

Papp, Henrietta and Tóth, Emese and Bovári-Biri, Judit and Bánfai, Krisztina and Juhász, Péter and Mahdi, M. and Russo, L.C. and Bajusz, Dávid and Sipos, Adrienn and Petri, László and Szalai, Tibor Viktor and Kemény, Ágnes and Madai, Mónika and Kuczmog, Anett and Batta, Gyula and Mózner, Orsolya and Vaskó, Dorottya and Hirsch, Edit and Bohus, P. and Méhes, Gábor and Tőzsér, József and Curtin, N.J. and Helyes, Zsuzsanna and Tóth, A. and Hoch, N.C. and Jakab, Ferenc and Keserű, György Miklós and Pongrácz, Judit and Bay, Péter (2024) The PARP inhibitor rucaparib blocks SARS-CoV-2 virus binding to cells and the immune reaction in models of COVID-19. BRITISH JOURNAL OF PHARMACOLOGY. ISSN 0007-1188

Godoy, Andre Schutzer and Minali Nakamura, Aline and Douangamath, Alice and Song, Yun and Noske, Gabriela Dias and Bajusz, Dávid and Borbás, Anikó and Keserű, György Miklós (2023) Allosteric regulation and crystallographic fragment screening of SARS-CoV-2 NSP15 endoribonuclease. NUCLEIC ACIDS RESEARCH, 51 (10). pp. 5255-5270. ISSN 0305-1048

Szepesi Kovács, Dénes and Kontra, Bence and Chiovini, Balázs and Müller, Dalma and Tóth, Estilla Zsófia and Ábrányi-Balogh, Péter and Wittner, Lucia and Várady, György and Turczel, Gábor and Farkas, Ödön and Owen, Michael C. and Katona, Gergely and Győrffy, Balázs and Keserű, György Miklós and Mucsi, Zoltán and Rózsa J., Balázs and Kovács, Ervin (2023) Effective Synthesis, Development and Application of a Highly Fluorescent Cyanine Dye for Antibody Conjugation and Microscopy Imaging. ORGANIC & BIOMOLECULAR CHEMISTRY, 21 (44). pp. 8829-8836. ISSN 1477-0520 (print); 1477-0539 (online)

Bajusz, Dávid and Pándy-Szekeres, Gáspár and Takács, Ágnes and de Araujo, Elvin D. and Keserű, György Miklós (2023) SH2db, an information system for the SH2 domain. NUCLEIC ACIDS RESEARCH, 51 (W1). W542-W552. ISSN 0305-1048

Szepesi Kovács, Dénes and Chiovini, Balázs and Müller, Dalma and Tóth, Estilla Zsófia and Fülöp, Anna and Ábrányi-Balogh, Péter and Wittner, Lucia and Várady, György and Farkas, Ödön and Turczel, Gábor and Katona, Gergely and Győrffy, Balázs and Keserű, György Miklós and Mucsi, Zoltán and Rózsa J., Balázs and Kovács, Ervin (2023) Synthesis and Application of Two-Photon Active Fluorescent Rhodol Dyes for Antibody Conjugation and in vitro Cell Imaging. ACS OMEGA, 8 (25). pp. 22836-22843. ISSN 2470-1343

Ábrányi-Balogh, Péter and Keeley, Aaron and Keserű, György Miklós (2022) Next-Generation Heterocyclic Electrophiles as Small-Molecule Covalent MurA Inhibitors. PHARMACEUTICALS, 15 (12). No.-1484. ISSN 1424-8247

Rácz, Anita and Palkó, Roberta and Csányi, Dorottya and Riedl, Zsuzsanna and Bajusz, Dávid and Keserű, György Miklós (2022) Consensus Virtual Screening Identified [1,2,4]Triazolo[1,5-b]isoquinolines As MELK Inhibitor Chemotypes. CHEMMEDCHEM, 17 (2). ISSN 1860-7179

Wakefield, Amanda E. and Bajusz, Dávid and Kozakov, Dima and Keserű, György Miklós and Vajda, Sandor (2022) Conservation of Allosteric Ligand Binding Sites in G-Protein Coupled Receptors. JOURNAL OF CHEMICAL INFORMATION AND MODELING, 62 (20). pp. 4937-4954. ISSN 1549-9596

Bajusz, Dávid and Keserű, György Miklós (2022) Maximizing the integration of virtual and experimental screening in hit discovery. EXPERT OPINION IN DRUG DISCOVERY, 17 (6). pp. 629-640. ISSN 1746-0441

Bakai-Bereczki, Ilona and Vimberg, Vladimir and Lőrincz, Eszter Boglárka and Papp, Henrietta and Nagy, Lajos and Kéki, Sándor and Batta, Gyula and Hajdú, István and Bajusz, Dávid and Petri, László and Jakab, Ferenc and Keserű, György Miklós and Herczegh, Pál and Borbás, Anikó (2022) Semisynthetic teicoplanin derivatives with dual antimicrobial activity against SARS-CoV-2 and multiresistant bacteria. SCIENTIFIC REPORTS, 12 (1). ISSN 2045-2322

Petri, László and Ábrányi-Balogh, Péter and Vagrys, Darius and Imre, Timea and Varró, Nikolett and Mándity, István and Rácz, Anita and Wittner, Lucia and Tóth, Kinga and Tóth, Estilla Zsófia and Juhász, Tünde and Davis, Ben and Keserű, György Miklós (2022) A covalent strategy to target intrinsically disordered proteins: Discovery of novel tau aggregation inhibitors. EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, 231. ISSN 0223-5234

Mihalovits, Levente Márk and Ferenczy, György and Keserű, György Miklós (2022) A kovalens enziminhibíció számításos kémiai jellemzése. MAGYAR KÉMIAI FOLYÓIRAT - KÉMIAI KÖZLEMÉNYEK (1997-), 128 (3-4). pp. 150-156. ISSN 1418-9933

Keserű, György Miklós (2021) Az akadémiai-ipari együttműködések szerepe a gyógyszerfejlesztésben pandémia idején = Drug Development Collaborations Between Academia and Industry in Pandemia. SCIENTIA ET SECURITAS, 2 (2). pp. 184-190. ISSN 2732-2688

Bajusz, Dávid and Bognár, Zsolt and Ebner, Jessica and Grebien, Florian and Keserű, György Miklós (2021) Discovery of a Non-Nucleoside SETD2 Methyltransferase Inhibitor against Acute Myeloid Leukemia. INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES, 22 (18). ISSN 1661-6596

Kollár, Levente and Gobec, Martina and Szilágyi, Bence and Proj, Matic and Knez, Damijan and Ábrányi-Balogh, Péter and Petri, László and Imre, Tímea and Bajusz, Dávid and Ferenczy, György and Keserű, György Miklós (2021) Discovery of selective fragment-sized immunoproteasome inhibitors. EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, 219. No.-113455. ISSN 0223-5234

Kemenesi, Gábor and Tóth, Gábor Endre and Bajusz, Dávid and Keserű, György Miklós and Terhes, Gabriella and Burián, Katalin and Zeghbib, Safia and Somogyi, Balázs Antal and Jakab, Ferenc (2021) Effect of An 84-bp Deletion of the Receptor-Binding Domain on the ACE2 Binding Affinity of the SARS-CoV-2 Spike Protein: An In Silico Analysis. GENES, 12 (2). No.-194. ISSN 2073-4425

Bajusz, Dávid and Wade, Warren S. and Satała, Grzegorz and Bojarski, Andrzej J. and Ilaš, Janez and Papp, Henrietta and Jakab, Ferenc and Keserű, György Miklós (2021) Exploring protein hotspots by optimized fragment pharmacophores. NATURE COMMUNICATIONS, 12 (1). ISSN 2041-1723

Bakai-Bereczki, Ilona and Papp, Henrietta and Kuczmog, Anett and Madai, Mónika and Nagy, Veronika and Agócs, Attila and Batta, Gyula and Milánkovits, Márton and Ostorházi, Eszter and Hajdú, István and Bajusz, Dávid and Keserű, György Miklós and Jakab, Ferenc and Herczegh, Pál and Borbás, Anikó (2021) Natural Apocarotenoids and Their Synthetic Glycopeptide Conjugates Inhibit SARS-CoV-2 Replication. PHARMACEUTICALS, 14 (11). ISSN 1424-8247

Prokop, Susanne Clara and Ábrányi-Balogh, Péter and Barti, Benjámin and Vámosi, Márton György and Zöldi, Miklós and Barna, László and Katona-Urbán, Gabriella and Tóth, András and Dudok, Barna and Egyed, Attila and Hunyady, László and Keserű, György Miklós and Katona, István (2021) PharmacoSTORM nanoscale pharmacology reveals cariprazine binding on Islands of Calleja granule cells. NATURE COMMUNICATIONS, 12 (1). ISSN 2041-1723

Keserű, György Miklós (2021) Vírusellenes terápiás lehetőségek COVID–19 fertőzés kezelésére. SCIENTIA ET SECURITAS, 2 (1). pp. 88-93. ISSN 2732-2688

Rachman, Moira and Bajusz, Dávid and Hetényi, Anasztázia and Scarpino, Andrea and Merő, Balázs László and Egyed, Attila and Buday, László and Keserű, György Miklós (2020) Discovery of a novel kinase hinge binder fragment by dynamic undocking. RSC Medicinal Chemistry, 11 (5). pp. 552-558. ISSN 2632-8682

Rachman, Moira and Scarpino, Andrea and Bajusz, Dávid and Pálfy, Gyula and Vida, István and Perczel, András and Barril, Xavier and Keserű, György Miklós (2019) DUckCov: a Dynamic Undocking‐Based Virtual Screening Protocol for Covalent Binders. CHEMMEDCHEM, 14 (10). pp. 1011-1021. ISSN 1860-7179

Boström, Jonas and Brown, Dean G. and Young, Robert J. and Keserű, György Miklós (2018) Expanding the medicinal chemistry synthetic toolbox. NATURE REVIEWS DRUG DISCOVERY, 17 (10). pp. 709-727. ISSN 1474-1776

Williams, Glyn and Ferenczy, György and Ulander, Johan and Keserű, György Miklós (2017) Binding thermodynamics discriminates fragments from druglike compounds: a thermodynamic description of fragment-based drug discovery. DRUG DISCOVERY TODAY, 22 (4). pp. 681-689. ISSN 1359-6446

Keserű, György Miklós and Erlanson, D. A. and Ferenczy, György and Hann, Michael M. and Murray, C. W. (2016) Design Principles for Fragment Libraries: Maximizing the Value of Learnings from Pharma Fragment-Based Drug Discovery (FBDD) Programs for Use in Academia. JOURNAL OF MEDICINAL CHEMISTRY, 59 (18). pp. 8189-8206. ISSN 0022-2623

Kelemen, Ádám Andor and Kiss, R. and Ferenczy, György and Kovács, L. and Flachner, Beáta and Keserű, György Miklós (2016) Structure-Based Consensus Scoring Scheme for Selecting Class A Aminergic GPCR Fragments. JOURNAL OF CHEMICAL INFORMATION AND MODELING, 56 (2). pp. 412-422. ISSN 1549-9596

Kiss, Róbert and Keserű, György Miklós (2016) Structure-based discovery and binding site analysis of histamine receptor ligands. EXPERT OPINION ON DRUG DISCOVERY, 11 (12). pp. 1165-1185. ISSN 1746-0441

Csimbók, Ervin and Takács, Daniella and Balog, József A. and Egyed, Orsolya and May-Nagy, Nóra V. and Keserű, György Miklós (2016) The first synthesis of isoxazolo[3,4-c]pyridine-7-ones. TETRAHEDRON LETTERS, 57 (39). pp. 4401-4404. ISSN 0040-4039

Szőllősi, Edit and Bobok, Amrita and Kiss, László and Vass, Márton and Kurkó, Dalma and Keserű, György Miklós (2015) Cell-based and virtual fragment screening for adrenergic a2C receptor agonists. BIOORGANIC & MEDICINAL CHEMISTRY, 23 (14). pp. 3991-3999. ISSN 0968-0896

Tarcsay, Ákos and Keserű, György Miklós (2015) Is there a link between selectivity and binding thermodynamics profiles? DRUG DISCOVERY TODAY, 20 (1). pp. 86-94. ISSN 1359-6446

Nógrádi, Katalin and Wágner, Gábor and Domány, György and Bobok, Amrita and Magdó, Ildikó and Keserű, György Miklós (2015) Thieno[2,3-b]pyridines as negative allosteric modulators of metabotropic GluR5 receptors: Lead optimization. BIOORGANIC & MEDICINAL CHEMISTRY LETTERS, 25. pp. 1724-1729. ISSN 0960-894X

Kelemen, Ádám Andor and Ferenczy, György and Keserű, György Miklós (2015) A desirability function-based scoring scheme for selecting fragment-like class A aminergic GPCR ligands. JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN, 29 (1). pp. 59-66. ISSN 0920-654X

Ferenczy, György and Keserű, György Miklós (2015) The impact of binding thermodynamics on medicinal chemistry optimizations. Future Medicinal Chemistry, 7 (10). pp. 1285-1303. ISSN 1756-8919

Keserű, György Miklós and Soós, Tibor and Kappe, CO (2014) Anthropogenic reaction parameters - the missing link between chemical intuition and the available chemical space. CHEMICAL SOCIETY REVIEWS, 43. pp. 5387-5399. ISSN 0306-0012

Baskin, R. and Park, SO. and Keserű, György Miklós and Bisht, KS. and Wamsley, HL. (2014) The Jak2 Small Molecule Inhibitor, G6, Reduces the Tumorigenic Potential of T98G Glioblastoma Cells In Vitro and In Vivo. PLOS ONE, 9 (8). e105568. ISSN 1932-6203

Vass, Márton and Ágai-Csongor, Éva and Horti, Ferenc and Keserű, György Miklós (2014) Multiple Fragment Docking and Linking in Primary and Secondary Pockets of Dopamine Receptors. ACS MEDICINAL CHEMISTRY LETTERS, 5 (9). pp. 1010-1014. ISSN 1948-5875

Szabó, György and Keserű, György Miklós (2014) Positive Allosteric Modulators for mGluR2 Receptors: A Medicinal Chemistry Perspective. CURRENT TOPICS IN MEDICINAL CHEMISTRY, 14 (15). pp. 1771-1788. ISSN 1568-0266

Polgár, Tímea and Keserű, György Miklós (2014) Structure-Based beta-Secretase (BACE1) Inhibitors. CURRENT PHARMACEUTICAL DESIGN, 20 (20). pp. 3373-3379. ISSN 1381-6128

Murray, C. W. and Erlanson, D. A. and Hopkins, A. L. and Keserű, György Miklós and Leeson, P. D. (2014) Validity of Ligand Efficiency Metrics. ACS MEDICINAL CHEMISTRY LETTERS, 5 (6). pp. 616-618. ISSN 1948-5875

Vass, Márton and Schmidt, Éva and Horti, Ferenc and Keserű, György Miklós (2014) Virtual fragment screening on GPCRs: A case study on dopamine D3 and histamine H4 receptors. EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, 77 (2). pp. 38-46. ISSN 0223-5234

Hopkins, Andrew L. and Keserű, György Miklós and Leeson, Paul D. and Rees, David C. and Reynolds, Charles H. (2014) The role of ligand efficiency metrics in drug discovery. NATURE REVIEWS DRUG DISCOVERY, 13 (2). pp. 105-121. ISSN 1474-1776

Tarcsay, Ákos and Keserű, György Miklós (2013) Contributions of Molecular Properties to Drug Promiscuity Miniperspective. Journal of Medicinal Chemistry, 56 (5). pp. 1789-1795. ISSN 0022-2623

Visegrády, András and Keserű, György Miklós (2013) Fragment-based lead discovery on G-protein-coupled receptors. EXPERT OPINION IN DRUG DISCOVERY, 8 (7). pp. 811-820. ISSN 1746-0441

Ferenczy, György G. and Keserű, György Miklós (2013) How fragments are optimized? A retrospective analysis of 145 fragment optimizations. Journal of Medicinal Chemistry, 56 (6). pp. 2478-2486. ISSN 0022-2623

Menyhárd, D.K. and Keserű, György Miklós and Náray-Szabó, Gábor (2009) Calmodulin in Complex with Proteins and Small Molecule Ligands: Operating with the Element of Surprise. Implications for Structure-Based Drug Design. Current Computer-Aided Drug Design, 5 (4). pp. 264-279.

Hajnal, Zoltán and Keserű, György Miklós and Simon, Kálmán (1999) A semiempirical approach to hydrogen bonding networks. Application of the Cyclic Cluster Model to organic crystals. Journal of Molecular Structure: THEOCHEM, 463 (1-2). pp. 169-174. ISSN 0166-1280

Monograph

Keserű, György Miklós and Karancsiné Menyhárd, Dóra and Kolossváry, István and Kovári, Zoltán (2008) Konformációs viszonyok és elektronszerkezet-változások vizsgálata fehérjékben = Investigation of conformational fluctuations and electronic structure variations in proteins. Project Report. OTKA.