Rubben Torella
Rubben Torella
Computational Chemist, Pfizer I&I
Verified email at - Homepage
Cited by
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Elabela/Toddler is an endogenous agonist of the apelin APJ receptor in the adult cardiovascular system, and exogenous administration of the peptide compensates for the …
P Yang, C Read, RE Kuc, G Buonincontri, M Southwood, R Torella, ...
Circulation 135 (12), 1160-1173, 2017
Design, characterization, and first-in-human study of the vascular actions of a novel biased apelin receptor agonist
AL Brame, JJ Maguire, P Yang, A Dyson, R Torella, J Cheriyan, M Singer, ...
Hypertension 65 (4), 834-840, 2015
Mechanism for priming DNA synthesis by yeast DNA polymerase α
RL Perera, R Torella, S Klinge, ML Kilkenny, JD Maman, L Pellegrini
Elife 2, e00482, 2013
Long-pentraxin 3 derivative as a small-molecule FGF trap for cancer therapy
R Ronca, A Giacomini, E Di Salle, D Coltrini, K Pagano, L Ragona, ...
Cancer cell 28 (2), 225-239, 2015
Structure and Function of the Su(H)-Hairless Repressor Complex, the Major Antagonist of Notch Signaling in Drosophila melanogaster
Z Yuan, H Praxenthaler, N Tabaja, R Torella, A Preiss, D Maier, RA Kovall
PLoS biology 14 (7), e1002509, 2016
Prediction of cytochrome P450 xenobiotic metabolism: tethered docking and reactivity derived from ligand molecular orbital analysis
JD Tyzack, MJ Williamson, R Torella, RC Glen
Journal of chemical information and modeling 53 (6), 1294-1305, 2013
Direct and allosteric inhibition of the FGF2/HSPGs/FGFR1 ternary complex formation by an antiangiogenic, thrombospondin-1-mimic small molecule
K Pagano, R Torella, C Foglieni, A Bugatti, S Tomaselli, L Zetta, M Presta, ...
PloS one 7 (5), e36990, 2012
Residues W320 and Y328 within the binding site of the μ-opioid receptor influence opiate ligand bias
JD Hothersall, R Torella, S Humphreys, M Hooley, A Brown, G McMurray, ...
Neuropharmacology 118, 46-58, 2017
Highly potent and selective NaV1. 7 inhibitors for use as intravenous agents and chemical probes
RI Storer, A Pike, NA Swain, AJ Alexandrou, BM Bechle, DC Blakemore, ...
Bioorganic & Medicinal Chemistry Letters 27 (21), 4805-4811, 2017
Lateral Fenestrations in K+-Channels Explored Using Molecular Dynamics Simulations
C Jorgensen, L Darré, V Oakes, R Torella, D Pryde, C Domene
Molecular pharmaceutics 13 (7), 2263-2273, 2016
Ensemble-and rigidity theory-based perturbation approach to analyze dynamic allostery
C Pfleger, A Minges, M Boehm, CL McClendon, R Torella, H Gohlke
Journal of chemical theory and computation 13 (12), 6343-6357, 2017
DeltaDelta neural networks for lead optimization of small molecule potency
J Jiménez-Luna, L Pérez-Benito, G Martínez-Rosell, S Sciabola, R Torella, ...
Chemical Science 10 (47), 10911-10918, 2019
Network-based drug discovery: coupling network pharmacology with phenotypic screening for neuronal excitability
B Sidders, A Karlsson, L Kitching, R Torella, P Karila, A Phelan
Journal of molecular biology 430 (18), 3005-3015, 2018
An intracellular allosteric modulator binding pocket in SK2 ion channels is shared by multiple chemotypes
LTY Cho, AJ Alexandrou, R Torella, J Knafels, J Hobbs, T Taylor, A Loucif, ...
Structure 26 (4), 533-544. e3, 2018
Investigating dynamic and energetic determinants of protein nucleic acid recognition: analysis of the zinc finger zif268-DNA complexes
R Torella, E Moroni, M Caselle, G Morra, G Colombo
BMC structural biology 10 (1), 42, 2010
A combination of computational and experimental approaches identifies DNA sequence constraints associated with target site binding specificity of the transcription factor CSL
R Torella, J Li, E Kinrade, G Cerda-Moya, AN Contreras, R Foy, R Stojnic, ...
Nucleic acids research 42 (16), 10550-10563, 2014
Discovery of compounds that positively modulate the high affinity choline transporter
P Choudhary, EJ Armstrong, CC Jorgensen, M Piotrowski, M Barthmes, ...
Frontiers in molecular neuroscience 10, 40, 2017
Cosolvent-enhanced sampling and unbiased identification of cryptic pockets suitable for structure-based drug design
D Schmidt, M Boehm, CL McClendon, R Torella, H Gohlke
Journal of chemical theory and computation 15 (5), 3331-3343, 2019
Valproic acid interactions with the NavMs voltage-gated sodium channel
G Zanatta, A Sula, AJ Miles, LCT Ng, R Torella, DC Pryde, PG DeCaen, ...
Proceedings of the National Academy of Sciences 116 (52), 26549-26554, 2019
Discovering New Casein Kinase 1d Inhibitors with an Innovative Molecular Dynamics Enabled Virtual Screening Workflow
S Sciabola, P Benedetti, G D’Arrigo, R Torella, M Baroni, G Cruciani, ...
ACS medicinal chemistry letters 10 (4), 487-492, 2018
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