Xavier Lucas
Xavier Lucas
Senior scientist in computational drug design at Monte Rosa Therapeutics, Basel
Verified email at - Homepage
Cited by
Cited by
Structural basis of PROTAC cooperative recognition for selective protein degradation
MS Gadd, A Testa, X Lucas, KH Chan, W Chen, DJ Lamont, M Zengerle, ...
Nature chemical biology 13 (5), 514-521, 2017
A thorough anion–π interaction study in biomolecules: on the importance of cooperativity effects
X Lucas, A Bauzá, A Frontera, D Quinonero
Chemical science 7 (2), 1038-1050, 2016
StreptomeDB: a resource for natural compounds isolated from Streptomyces species
X Lucas, C Senger, A Erxleben, BA Grüning, K Döring, J Mosch, ...
Nucleic acids research 41 (D1), D1130-D1136, 2012
4-Acyl Pyrroles: Mimicking Acetylated Lysines in Histone Code Reading
X Lucas, D Wohlwend, M Hügle, K Schmidtkunz, S Gerhardt, R Schüle, ...
Angewandte Chemie International Edition 52 (52), 14055-9, 2013
Structure‐Based Design of a Macrocyclic PROTAC
A Testa, SJ Hughes, X Lucas, JE Wright, A Ciulli
Angewandte Chemie 132 (4), 1744-1751, 2020
StreptomeDB 2.0—an extended resource of natural products produced by streptomycetes
D Klementz, K Döring, X Lucas, KK Telukunta, A Erxleben, D Deubel, ...
Nucleic acids research 44 (D1), D509-D514, 2016
3-Fluoro-4-hydroxyprolines: synthesis, conformational analysis, and stereoselective recognition by the VHL E3 ubiquitin ligase for targeted protein degradation
A Testa, X Lucas, GV Castro, KH Chan, JE Wright, AC Runcie, MS Gadd, ...
Journal of the American Chemical Society 140 (29), 9299-9313, 2018
Very long‐range effects: cooperativity between anion–π and hydrogen‐bonding interactions
X Lucas, C Estarellas, D Escudero, A Frontera, D Quiñonero, PM Deyà
ChemPhysChem 10 (13), 2256-2264, 2009
Virtual screening strategies in drug design–methods and applications
E Bielska, X Lucas, A Czerwoniec, JM Kasprzak, KH Kamińska, ...
Biotechnologia 92 (3), 249-64, 2011
Recognition of substrate degrons by E3 ubiquitin ligases and modulation by small-molecule mimicry strategies
X Lucas, A Ciulli
Current opinion in structural biology 44, 101-110, 2017
Development and Benchmarking of Open Force Field v1. 0.0—the Parsley Small-Molecule Force Field
Y Qiu, DGA Smith, S Boothroyd, H Jang, DF Hahn, J Wagner, CC Bannan, ...
Journal of chemical theory and computation 17 (10), 6262-6280, 2021
4-Acyl pyrrole derivatives yield novel vectors for designing inhibitors of the acetyl-lysine recognition site of BRD4 (1)
M Hügle, X Lucas, G Weitzel, D Ostrovskyi, B Breit, S Gerhardt, O Einsle, ...
Journal of medicinal chemistry 59 (4), 1518-1530, 2016
Counterintuitive Substituent Effect of the Ethynyl Group in Ion− π Interactions
X Lucas, D Quinonero, A Frontera, PM Deya
The Journal of Physical Chemistry A 113 (38), 10367-10375, 2009
The Purchasable Chemical Space: a Detailed Picture
X Lucas, BA Grüning, S Bleher, S Günther
Journal of Chemical Information and Modeling, 2015
Structural basis of molecular recognition of helical histone H3 tail by PHD finger domains
A Bortoluzzi, A Amato, X Lucas, M Blank, A Ciulli
Biochemical Journal 474 (10), 1633-1651, 2017
Beyond the BET family: targeting CBP/p300 with 4‐acyl pyrroles
M Hügle, X Lucas, D Ostrovskyi, P Regenass, S Gerhardt, O Einsle, ...
Angewandte Chemie International Edition 56 (41), 12476-12480, 2017
Surface probing by fragment-based screening and computational methods identifies ligandable pockets on the von Hippel–Lindau (VHL) E3 ubiquitin ligase
X Lucas, I Van Molle, A Ciulli
Journal of medicinal chemistry 61 (16), 7387-7393, 2018
Targeting ligandable pockets on plant homeodomain (PHD) zinc finger domains by a fragment-based approach
A Amato, X Lucas, A Bortoluzzi, D Wright, A Ciulli
ACS chemical biology 13 (4), 915-921, 2018
Target fishing by cross‐docking to explain polypharmacological effects
H Patel, X Lucas, I Bendik, S Günther, I Merfort
ChemMedChem 10 (7), 1209-1217, 2015
Substituent Effects in Ion− π Interactions: Fine-Tuning via the Ethynyl Group
X Lucas, A Frontera, D Quinonero, PM Deya
The Journal of Physical Chemistry A 114 (4), 1926-1930, 2010
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