Publications

Abel AC, Mühlethaler T, Dessin C, Schachtsiek T, Sammet B, Sharpe T, et al.
Bridging the maytansine and vinca sites: Cryptophycins target β-tubulin's T5-loop
Journal of Biological Chemistry. 2024; 300(6): 107363 (10 pp.). https://doi.org/10.1016/j.jbc.2024.107363
DORA PSI

Aksu M, Kumar P, Güttler T, Taxer W, Gregor K, Mußil B, et al.
Nanobodies to multiple spike variants and inhalation of nanobody-containing aerosols neutralize SARS-CoV-2 in cell culture and hamsters
Antiviral Research. 2024; 221: 105778 (21 pp.). https://doi.org/10.1016/j.antiviral.2023.105778
DORA PSI

Baltgalvis KA, Lamb KN, Symons KT, Wu CC, Hoffman MA, Snead AN, et al.
Chemoproteomic discovery of a covalent allosteric inhibitor of WRN helicase
Nature. 2024; 629(8011): 435-442. https://doi.org/10.1038/s41586-024-07318-y
DORA PSI

Butini S, Grether U, Jung KM, Ligresti A, Allarà M, Postmus AGJ, et al.
Development of potent and selective monoacylglycerol lipase inhibitors. SARs, structural analysis, and biological characterization
Journal of Medicinal Chemistry. 2024; 67(3): 1758-1782. https://doi.org/10.1021/acs.jmedchem.3c01278
DORA PSI

Carney DW, Leffler AE, Bell JA, Chandrasinghe AS, Cheng C, Chang E, et al.
Exploiting high-energy hydration sites for the discovery of potent peptide aldehyde inhibitors of the SARS-CoV-2 main protease with cellular antiviral activity
Bioorganic and Medicinal Chemistry. 2024; 103: 117577 (27 pp.). https://doi.org/10.1016/j.bmc.2023.117577
DORA PSI

Chapeau EA, Sansregret L, Galli GG, Chène P, Wartmann M, Mourikis TP, et al.
Direct and selective pharmacological disruption of the YAP–TEAD interface by IAG933 inhibits Hippo-dependent and RAS–MAPK-altered cancers
Nature Cancer. 2024; 5(7): 1102-1120. https://doi.org/10.1038/s43018-024-00754-9
DORA PSI

DeRatt LG, Zhang Z, Pietsch C, Cisar JS, Zhang X, Wang W, et al.
Discovery of JNJ-74856665: a novel isoquinolinone DHODH inhibitor for the treatment of AML
Journal of Medicinal Chemistry. 2024; 67: 11254-11272. https://doi.org/10.1021/acs.jmedchem.4c00809
DORA PSI

DeRatt LG, Pietsch EC, Cisar JS, Jacoby E, Kazmi F, Matico R, et al.
Discovery of alternative binding poses through fragment-based identification of DHODH inhibitors
ACS Medicinal Chemistry Letters. 2024; 15(3): 381-387. https://doi.org/10.1021/acsmedchemlett.3c00543
DORA PSI

DeRatt LG, Zhang Z, Pietsch EC, Cisar J, Wang A, Wang C yuan, et al.
Identification of isoquinolinone DHODH inhibitor isosteres
Bioorganic and Medicinal Chemistry Letters. 2024; 113: 129965 (7 pp.). https://doi.org/10.1016/j.bmcl.2024.129965
DORA PSI

Fernández-Quintero ML, Guarnera E, Musil D, Pekar L, Sellmann C, Freire F, et al.
On the humanization of VHHs: Prospective case studies, experimental and computational characterization of structural determinants for functionality
Protein Science. 2024; 33(11): e5176 (25 pp.). https://doi.org/10.1002/pro.5176
DORA PSI

Ferretti S, Hamon J, de Kanter R, Scheufler C, Andraos-Rey R, Barbe S, et al.
Discovery of WRN inhibitor HRO761 with synthetic lethality in MSI cancers
Nature. 2024; 629(8011): 443-449. https://doi.org/10.1038/s41586-024-07350-y
DORA PSI

Gehl M, Demmer U, Ermler U, Shima S
Mutational and structural studies of (βα)₈-barrel fold methylene-tetrahydropterin reductases utilizing a common catalytic mechanism
Protein Science. 2024; 33(6): e5018 (18 pp.). https://doi.org/10.1002/pro.5018
DORA PSI

Gotthard G, Mous S, Weinert T, Maia RNA, James D, Dworkowski F, et al.
Capturing the blue-light activated state of the Phot-LOV1 domain from Chlamydomonas reinhardtii using time-resolved serial synchrotron crystallography
IUCrJ. 2024; 11(5): (17 pp.). https://doi.org/10.1107/S2052252524005608
DORA PSI

Halldórsson S, Hillringhaus L, Hojer C, Muranyi A, Schraeml M, Swiatek-de Lange M, et al.
Development of a first-in-class antibody and a specific assay for α-1,6-fucosylated prostate-specific antigen
Scientific Reports. 2024; 14(1): 16512 (11 pp.). https://doi.org/10.1038/s41598-024-67545-1
DORA PSI

Heine N, Weber A, Pautsch A, Gottschling D, Uphues I, Bauer M, et al.
Discovery of BI-9787, a potent zwitterionic ketohexokinase inhibitor with oral bioavailability
Bioorganic and Medicinal Chemistry Letters. 2024; 112: 129930 (9 pp.). https://doi.org/10.1016/j.bmcl.2024.129930
DORA PSI

Hu Y, Schwab S, Deiss S, Escudeiro P, Van Heesch T, Joiner JD, et al.
Bacterial histone HBb from Bdellovibrio bacteriovorus compacts DNA by bending
Nucleic Acids Research. 2024; 52(14): 8193-8204. https://doi.org/10.1093/nar/gkae485
DORA PSI

Huang C-Y, Aumonier S, Olieric V, Wang M
Cryo2RT: a high-throughput method for room-temperature macromolecular crystallography from cryo-cooled crystals
Acta Crystallographica Section D: Structural Biology. 2024; 80(8): 620-628. https://doi.org/10.1107/S2059798324006697
DORA PSI

Huppertz M-C, Wilhelm J, Grenier V, Schneider MW, Falt T, Porzberg N, et al.
Recording physiological history of cells with chemical labeling
Science. 2024; 383(6685): 890-897. https://doi.org/10.1126/science.adg0812
DORA PSI

Joshi T, Demmer U, Schneider C, Glaser T, Warkentin E, Ermler U, et al.
The Phosphatase RosC from Streptomyces davaonensis is Used for Roseoflavin Biosynthesis and has Evolved to Largely Prevent Dephosphorylation of the Important Cofactor Riboflavin-5′-phosphate
Journal of Molecular Biology. 2024; 436(20): 168734 (14 pp.). https://doi.org/10.1016/j.jmb.2024.168734
DORA PSI

Kageji H, Momose T, Nagamoto Y, Togashi N, Yasumatsu I, Nishikawa Y, et al.
Synthesis, activity, and their relationships of 2,4-diaminonicotinamide derivatives as EGFR inhibitors targeting C797S mutation
Bioorganic and Medicinal Chemistry Letters. 2024; 98: 129575 (7 pp.). https://doi.org/10.1016/j.bmcl.2023.129575
DORA PSI

Kawano S, Kawada MI, Fukushima S, Arai Y, Shibata T, Miyano SW
Antitumor activity of Tasurgratinib as an orally available FGFR1-3 inhibitor in Cholangiocarcinoma models with FGFR2-fusion
Anticancer Research. 2024; 44(6): 2393-2406. https://doi.org/10.21873/anticanres.17046
DORA PSI

Kotschy J, Söldner B, Singh H, Vasa SK, Linser R
Microsecond timescale conformational dynamics of a small-molecule ligand within the active site of a protein
Angewandte Chemie International Edition. 2024; 63(5): e202313947 (6 pp.). https://doi.org/10.1002/anie.202313947
DORA PSI

Kozicka Z, Suchyta DJ, Focht V, Kempf G, Petzold G, Jentzsch M, et al.
Design principles for cyclin K molecular glue degraders
Nature Chemical Biology. 2024; 20(1): 93-102. https://doi.org/10.1038/s41589-023-01409-z
DORA PSI

Langer LM, Kurscheidt K, Basquin J, Bonneau F, Iermak I, Basquin C, et al.
UPF1 helicase orchestrates mutually exclusive interactions with the SMG6 endonuclease and UPF2
Nucleic Acids Research. 2024; 52(10): 6036-6048. https://doi.org/10.1093/nar/gkae323
DORA PSI

McCarver S, Hanna L, Samant A, Thompson AA, Seierstad M, Saha A, et al.
Structure-based optimization of selective and brain penetrant CK1δ inhibitors for the treatment of circadian disruptions
ACS Medicinal Chemistry Letters. 2024; 15(4): 486-492. https://doi.org/10.1021/acsmedchemlett.3c00523
DORA PSI

Meibom D, Wasnaire P, Beyer K, Broehl A, Cancho-Grande Y, Elowe N, et al.
BAY-9835: discovery of the first orally bioavailable ADAMTS7 inhibitor
Journal of Medicinal Chemistry. 2024; 67(4): 2907-2940. https://doi.org/10.1021/acs.jmedchem.3c02036
DORA PSI

Melero C, Budiardjo SJ, Daruwalla A, Larrabee L, Ganichkin O, Heiler AJ, et al.
CD200R1 immune checkpoint blockade by the first-in-human anti-CD200R1 antibody 23ME-00610: molecular mechanism and engineering of a surrogate antibody
mAbs. 2024; 16(1): 2410316 (13 pp.). https://doi.org/10.1080/19420862.2024.2410316
DORA PSI

Murer P, Brannetti B, Rondeau JM, Petersen L, Egli N, Popp S, et al.
Discovery and development of ANV419, an IL-2/anti-IL-2 antibody fusion protein with potent CD8+ T and natural killer cell-stimulating capacity for cancer immunotherapy
mAbs. 2024; 16(1): 2381891 (15 pp.). https://doi.org/10.1080/19420862.2024.2381891
DORA PSI

Münzker L, Kimani SW, Fowkes MM, Dong A, Zheng H, Li Y, et al.
A ligand discovery toolbox for the WWE domain family of human E3 ligases
Communications Biology. 2024; 7(1): 901 (15 pp.). https://doi.org/10.1038/s42003-024-06584-w
DORA PSI

Popow J, Farnaby W, Gollner A, Kofink C, Fischer G, Wurm M, et al.
Targeting cancer with small-molecule pan-KRAS degraders
Science. 2024; 385(6715): 1338-1347. https://doi.org/10.1126/science.adm8684
DORA PSI

Porfetye AT, Stege P, Rebollido-Rios R, Hoffmann D, Schrader T, Vetter IR
How Do molecular tweezers bind to proteins? Lessons from X-ray crystallography
Molecules. 2024; 29(8): 1764. https://doi.org/10.3390/molecules29081764
DORA PSI

Schmidt M, Grethe C, Recknagel S, Kipka GM, Klink N, Gersch M
N-cyanopiperazines as specific covalent inhibitors of the deubiquitinating enzyme UCHL1
Angewandte Chemie International Edition. 2024; 63(12): e202318849 (10 pp.). https://doi.org/10.1002/anie.202318849
DORA PSI

Schwab S, Hu Y, van Erp B, Cajili MKM, Hartmann MD, Hernandez Alvarez B, et al.
Histones and histone variant families in prokaryotes
Nature Communications. 2024; 15(1): 7950 (13 pp.). https://doi.org/10.1038/s41467-024-52337-y
DORA PSI

Shevalev R, Bischof L, Sapegin A, Bunev A, Olga G'eva, Kantin G, et al.
Discovery and characterization of potent spiro-isoxazole-based cereblon ligands with a novel binding mode
European Journal of Medicinal Chemistry. 2024; 270: 116328 (10 pp.). https://doi.org/10.1016/j.ejmech.2024.116328
DORA PSI

Skudlarek JW, Cooke AJ, Mitchell HJ, Babaoglu K, Shaw AW, Tong L, et al.
Cerastecin inhibition of the lipooligosaccharide transporter MsbA to combat Acinetobacter baumannii: from screening impurity to in Vivo efficacy
Journal of Medicinal Chemistry. 2024; 67: 15620-15675. https://doi.org/10.1021/acs.jmedchem.4c01277
DORA PSI

Solà Colom M, Fu Z, Gunkel P, Güttler T, Trakhanov S, Srinivasan V, et al.
A checkpoint function for Nup98 in nuclear pore formation suggested by novel inhibitory nanobodies
EMBO Journal. 2024; 43(11): 2198-2232. https://doi.org/10.1038/s44318-024-00081-w
DORA PSI

Teuber A, Schulz T, Fletcher BS, Gontla R, Mühlenberg T, Zischinsky M-L, et al.
Avapritinib-based SAR studies unveil a binding pocket in KIT and PDGFRA
Nature Communications. 2024; 15(1): 63 (11 pp.). https://doi.org/10.1038/s41467-023-44376-8
DORA PSI

Thisted T, Smith FD, Mukherjee A, Kleschenko Y, Feng F, Jiang ZG, et al.
VISTA checkpoint inhibition by pH-selective antibody SNS-101 with optimized safety and pharmacokinetic profiles enhances PD-1 response
Nature Communications. 2024; 15(1): 2917 (16 pp.). https://doi.org/10.1038/s41467-024-47256-x
DORA PSI

Thoma G, Miltz W, Srinivas H, Penno CA, Kiffe M, Gajewska M, et al.
Structure-guided elaboration of a fragment-like hit into an orally efficacious leukotriene A4 hydrolase inhibitor
Journal of Medicinal Chemistry. 2024; 67(6): 5093-5108. https://doi.org/10.1021/acs.jmedchem.4c00290
DORA PSI

Toledo-Patiño S, Goetz SK, Shanmugaratnam S, Höcker B, Farías-Rico JA
Molecular handcraft of a well-folded protein chimera
FEBS Letters. 2024; 598(11): 1375-1386. https://doi.org/10.1002/1873-3468.14856
DORA PSI

Vandyck K, McGowan DC, Luong XG, Stevens SK, Jekle A, Gupta K, et al.
Discovery and preclinical profile of ALG-055009, a potent and selective thyroid hormone receptor beta (THR-β) agonist for the treatment of MASH
Journal of Medicinal Chemistry. 2024; 67: 14840-14851. https://doi.org/10.1021/acs.jmedchem.4c01029
DORA PSI

Velcicky J, Bauer MR, Schlapbach A, Lapointe G, Meyer A, Vögtle M, et al.
Discovery and In vivo exploration of 1,3,4-oxadiazole and α-fluoroacrylate containing IL-17 inhibitors
Journal of Medicinal Chemistry. 2024; 67(18): 16692-16711. https://doi.org/10.1021/acs.jmedchem.4c01520
DORA PSI

Vulpetti A, Rondeau JM, Bellance MH, Blank J, Boesch R, Boettcher A, et al.
Ligandability assessment of IL-1β by integrated hit identification approaches
Journal of Medicinal Chemistry. 2024; 67: 8141-8160. https://doi.org/10.1021/acs.jmedchem.4c00240
DORA PSI

Abe-Sato K, Tabuse H, Kanazawa H, Kamitani M, Endo M, Tokura S, et al.
Structure-based optimization and biological evaluation of potent and selective MMP-7 inhibitors for kidney fibrosis
Journal of Medicinal Chemistry. 2023; 66(21): 14653-14668. https://doi.org/10.1021/acs.jmedchem.3c01166
DORA PSI

Adam S, Zheng D, Klein A, Volz C, Mullen W, Shirran SL, et al.
Unusual peptide-binding proteins guide pyrroloindoline alkaloid formation in crocagin biosynthesis
Nature Chemistry. 2023; 15(4): 560-568. https://doi.org/10.1038/s41557-023-01153-w
DORA PSI

Alper P, Betschart C, André C, Boulay T, Cheng D, Deane J, et al.
Discovery of the TLR7/8 antagonist MHV370 for treatment of systemic autoimmune diseases
ACS Medicinal Chemistry Letters. 2023; 14(8): 1054-1062. https://doi.org/10.1021/acsmedchemlett.3c00136
DORA PSI

Berneburg I, Stumpf M, Velten A-S, Rahlfs S, Przyborski J, Becker K, et al.
Structure of Leishmania donovani 6-phosphogluconate dehydrogenase and inhibition by phosphine gold(I) complexes: a potential approach to leishmaniasis treatment
International Journal of Molecular Sciences. 2023; 24(10): 8615 (20 pp.). https://doi.org/10.3390/ijms24108615
DORA PSI

Blum A, Dorsch D, Linde N, Brandstetter S, Buchstaller H-P, Busch M, et al.
Identification of M4205 - a highly selective inhibitor of KIT mutations for treatment of unresectable metastatic or recurrent gastrointestinal stromal tumors
Journal of Medicinal Chemistry. 2023; 66(4): 2386-2395. https://doi.org/10.1021/acs.jmedchem.2c00851
DORA PSI

Boland C, Huang C-Y, Shanker Kaki S, Wang M, Olieric V, Caffrey M
Se-MAG is a convenient additive for experimental phasing and structure determination of membrane proteins crystallised by the lipid cubic phase (in meso) method
Crystals. 2023; 13(9): 1402 (20 pp.). https://doi.org/10.3390/cryst13091402
DORA PSI

Bothe U, Günther J, Nubbemeyer R, Siebeneicher H, Ring S, Bömer U, et al.
Discovery of IRAK4 Inhibitors BAY1834845 (Zabedosertib) and BAY1830839
Journal of Medicinal Chemistry. 2023; 67: 1125-1242. https://doi.org/10.1021/acs.jmedchem.3c01714
DORA PSI

Buchstaller H-P, Sala-Hojman A, Leiendecker M, Albers J, Anlauf U, Berges N, et al.
Discovery of cycloalkyl[c]thiophenes as novel scaffolds for hypoxia-inducible factor-2α inhibitors
Journal of Medicinal Chemistry. 2023; 66(13): 8666-8686. https://doi.org/10.1021/acs.jmedchem.3c00332
DORA PSI

Bührmann M, Kallepu S, Warmuth JD, Wiese JN, Ehrt C, Vatheuer H, et al.
FRAGTORY: pharmacophore-focused design, synthesis, and evaluation of an sp³-enriched fragment library
Journal of Medicinal Chemistry. 2023; 66(9): 6297-6314. https://doi.org/10.1021/acs.jmedchem.3c00187
DORA PSI

Chen X-R, Poudel L, Hong Z, Johnen P, Katti S, Tripathi A, et al.
Mechanisms by which small molecules of diverse chemotypes arrest Sec14 lipid transfer activity
Journal of Biological Chemistry. 2023; 299(2): 102861 (21 pp.). https://doi.org/10.1016/j.jbc.2022.102861
DORA PSI

Claff T, Schlegel JG, Voss JH, Vaaßen VJ, Weiße RH, Cheng RKY, et al.
Crystal structure of adenosine A_2A receptor in complex with clinical candidate Etrumadenant reveals unprecedented antagonist interaction
Communications Chemistry. 2023; 6(1): 106 (10 pp.). https://doi.org/10.1038/s42004-023-00894-6
DORA PSI

Cumming JG, Kreis L, Kühne H, Wermuth R, Vercruysse M, Kramer C, et al.
Discovery of a series of indane-containing NBTIs with activity against multidrug-resistant gram-negative pathogens
ACS Medicinal Chemistry Letters. 2023; 14(7): 993-998. https://doi.org/10.1021/acsmedchemlett.3c00187
DORA PSI

Demin S, Peschiulli A, Velter AI, Vos A, De Boeck B, Miller B, et al.
Macrocyclic carbon-linked pyrazoles as novel inhibitors of MCL-1
ACS Medicinal Chemistry Letters. 2023; 14(7): 955-961. https://doi.org/10.1021/acsmedchemlett.3c00141
DORA PSI

Dietl A, Wellach K, Mahadevan P, Mertes N, Winter SL, Kutsch T, et al.
Structures of an unusual 3-hydroxyacyl dehydratase (FabZ) from a ladderane-producing organism with an unexpected substrate preference
Journal of Biological Chemistry. 2023; 299(5): 104602 (15 pp.). https://doi.org/10.1016/j.jbc.2023.104602
DORA PSI

Dillenberger M, Werner A-D, Velten A-S, Rahlfs S, Becker K, Fritz-Wolf K
Structural analysis of Plasmodium falciparum hexokinase provides novel information about catalysis due to a Plasmodium-specific insertion
International Journal of Molecular Sciences. 2023; 24(16): 12739 (20 pp.). https://doi.org/10.3390/ijms241612739
DORA PSI

Duan J, Hemschemeier A, Burr DJ, Stripp ST, Hofmann E, Happe T
Cyanide binding to [FeFe]-hydrogenase stabilizes the alternative configuration of the proton transfer pathway
Angewandte Chemie International Edition. 2023; 62(7): e202216903 (4 pp.). https://doi.org/10.1002/anie.202216903
DORA PSI

Dunbar KL, Perlatti B, Liu N, Cornelius A, Mummau D, Chiang Y-M, et al.
Resistance gene–guided genome mining reveals the roseopurpurins as inhibitors of cyclin-dependent kinases
Proceedings of the National Academy of Sciences of the United States of America PNAS. 2023; 120(48): e2310522120 (10 pp.). https://doi.org/10.1073/pnas.2310522120
DORA PSI

Duvall JR, Thomas JD, Bukhalid RA, Catcott KC, Bentley KW, Collins SD, et al.
Discovery and optimization of a STING agonist platform for application in antibody drug conjugates
Journal of Medicinal Chemistry. 2023; 66(15): 10715-10733. https://doi.org/10.1021/acs.jmedchem.3c00907
DORA PSI

Ebenhoch R, Bauer M, Romig H, Gottschling D, Kley JT, Heine N, et al.
Crystal structures of human and mouse ketohexokinase provide a structural basis for species- and isoform-selective inhibitor design
Acta Crystallographica Section D: Structural Biology. 2023; 79(10): 871-880. https://doi.org/10.1107/S2059798323006137
DORA PSI

Fedir B, Yannick M, Marco M, Patrizia F, Catherine Z, Frédéric V, et al.
N‐terminal β‐strand in YAP is critical for stronger binding to scalloped relative to TEAD transcription factor
Protein Science. 2023; 32(1): e4545 (13 pp.). https://doi.org/10.1002/pro.4545
DORA PSI

Fischman S, Levin I, Rondeau J-M, Štrajbl M, Lehmann S, Huber T, et al.
"Redirecting an anti-IL-1β antibody to bind a new, unrelated and computationally predicted epitope on hIL-17A"
Communications Biology. 2023; 6(1): 997 (13 pp.). https://doi.org/10.1038/s42003-023-05369-x
DORA PSI

Gehl M, Demmer U, Ermler U, Shima S
Crystal structure of FAD-independent methylene-tetrahydrofolate reductase from Mycobacterium hassiacum
Proteins. 2023; 91(9): 1329-1340. https://doi.org/10.1002/prot.26504
DORA PSI

Goebel L, Kirschner T, Koska S, Rai A, Janning P, Maffini S, et al.
Targeting oncogenic KRasG13C with nucleotide-based covalent inhibitors
eLife. 2023; 12: e82184 (22 pp.). https://doi.org/10.7554/elife.82184
DORA PSI

Grädler U, Schwarz D, Wegener A, Eichhorn T, Bandeiras TM, Freitas MC, et al.
Biophysical and structural characterization of the impacts of MET phosphorylation on tepotinib binding
Journal of Biological Chemistry. 2023; 299(11): 105328 (14 pp.). https://doi.org/10.1016/j.jbc.2023.105328
DORA PSI

Guerlavais V, Sawyer TK, Carvajal L, Chang YS, Graves B, Ren J-G, et al.
Discovery of sulanemadlin (ALRN-6924), the first cell-permeating, stabilized α-helical peptide in clinical development
Journal of Medicinal Chemistry. 2023; 66(14): 9401-9417. https://doi.org/10.1021/acs.jmedchem.3c00623
DORA PSI

Heim C, Spring A-K, Kirchgäßner S, Schwarzer D, Hartmann MD
Cereblon neo-substrate binding mimics the recognition of the cyclic imide degron
Biochemical and Biophysical Research Communications. 2023; 646: 30-35. https://doi.org/10.1016/j.bbrc.2023.01.051
DORA PSI

Hellweg L, Edenhofer A, Barck L, Huppertz MC, Frei MS, Tarnawski M, et al.
A general method for the development of multicolor biosensors with large dynamic ranges
Nature Chemical Biology. 2023; 19: 1147-1157. https://doi.org/10.1038/s41589-023-01350-1
DORA PSI

Hiemstra IH, Santegoets KCM, Janmaat ML, De Goeij BECG, Ten Hagen W, van Dooremalen S, et al.
Preclinical anti-tumour activity of HexaBody-CD38, a next-generation CD38 antibody with superior complement-dependent cytotoxic activity
EBioMedicine. 2023; 93: 104663 (19 pp.). https://doi.org/10.1016/j.ebiom.2023.104663
DORA PSI

Hommel U, Hurth K, Rondeau J-M, Vulpetti A, Ostermeier D, Boettcher A, et al.
Discovery of a selective and biologically active low-molecular weight antagonist of human interleukin-1β
Nature Communications. 2023; 14(1): 5497 (13 pp.). https://doi.org/10.1038/s41467-023-41190-0
DORA PSI

Imai Y, Suzuki R, Wakasugi D, Matsuda D, Tanaka-Yamamoto N, Ohki Y, et al.
Structure-based lead optimization to improve potency and selectivity of a novel tetrahydroimidazo[1,2-a]pyridine-5-carboxylic acid series of heparanase-1 inhibitor
Bioorganic and Medicinal Chemistry. 2023; 93: 117460 (15 pp.). https://doi.org/10.1016/j.bmc.2023.117460
DORA PSI

Kalliokoski T, Kettunen H, Kumpulainen E, Kettunen E, Thieulin-Pardo G, Neumann L, et al.
Discovery of novel methionine adenosyltransferase 2A (MAT2A) allosteric inhibitors by structure-based virtual screening
Bioorganic and Medicinal Chemistry Letters. 2023; 94: 129450 (8 pp.). https://doi.org/10.1016/j.bmcl.2023.129450
DORA PSI

Kim D, Herdeis L, Rudolph D, Zhao Y, Böttcher J, Vides A, et al.
Pan-KRAS inhibitor disables oncogenic signalling and tumour growth
Nature. 2023; 619(7968): 160-166. https://doi.org/10.1038/s41586-023-06123-3
DORA PSI

Kompa J, Bruins J, Glogger M, Wilhelm J, Frei MS, Tarnawski M, et al.
Exchangeable HaloTag ligands for super-resolution fluorescence microscopy
Journal of the American Chemical Society. 2023; 145(5): 3075-3083. https://doi.org/10.1021/jacs.2c11969
DORA PSI

Krasavin M, Adamchik M, Bubyrev A, Heim C, Maiwald S, Zhukovsky D, et al.
Synthesis of novel glutarimide ligands for the E3 ligase substrate receptor Cereblon (CRBN): Investigation of their binding mode and antiproliferative effects against myeloma cell lines
European Journal of Medicinal Chemistry. 2023; 246: 114990 (12 pp.). https://doi.org/10.1016/j.ejmech.2022.114990
DORA PSI

Krieger J, Sorrell FJ, Wegener AA, Leuthner B, Machrouhi-Porcher F, Hecht M, et al.
Systematic potency and property assessment of VHL ligands and implications on PROTAC design
ChemMedChem. 2023; 18(8): e202200615 (11 pp.). https://doi.org/10.1002/cmdc.202200615
DORA PSI

Kuhn B, Ritter M, Benz J, Kocer B, Sarie JC, Hochstrasser R, et al.
Novel potent and highly selective DDR1 inhibitors from integrated lead finding
Medicinal Chemistry Research. 2023; 32(7): 1400-1425. https://doi.org/10.1007/s00044-023-03066-2
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Rutz S, Deneka D, Dittmann A, Sawicka M, Dutzler R
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High-resolution structures of the bound effectors avadomide (CC-122) and iberdomide (CC-220) highlight advantages and limitations of the MsCI4 soaking system
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