Related references
Note: Only part of the references are listed.Crystallographic screening using ultra-low-molecular-weight ligands to guide drug design
Marc O'Reilly et al.
DRUG DISCOVERY TODAY (2019)
High-throughput stability screening for detergent-solubilized membrane proteins
Vadim Kotov et al.
SCIENTIFIC REPORTS (2019)
Novel non-linear curve fitting to resolve protein unfolding transitions in intrinsic fluorescence differential scanning fluorimetry
Dillen Augustijn et al.
EUROPEAN JOURNAL OF PHARMACEUTICS AND BIOPHARMACEUTICS (2019)
Fragment screening for a protein-protein interaction inhibitor to WDR5
Matthew L. Dennis et al.
STRUCTURAL DYNAMICS-US (2019)
Ligand-Based Fluorine NMR Screening: Principles and Applications in Drug Discovery Projects
Claudio Dalvit et al.
JOURNAL OF MEDICINAL CHEMISTRY (2019)
Fragment-Based Drug Discovery: Advancing Fragments in the Absence of Crystal Structures
Daniel A. Erlanson et al.
CELL CHEMICAL BIOLOGY (2019)
Current NMR Techniques for Structure-Based Drug Discovery
Toshihiko Sugiki et al.
MOLECULES (2018)
Seven Year Itch: Pan-Assay Interference Compounds (PAINS) in 2017-Utility and Limitations
Jonathan B. Baell et al.
ACS CHEMICAL BIOLOGY (2018)
19F NMR transverse and longitudinal relaxation filter experiments for screening: a theoretical and experimental analysis
Claudio Dalvit et al.
MAGNETIC RESONANCE IN CHEMISTRY (2017)
Hot-Spotting with Thermal Scanning: A Ligand- and Structure-Independent Assessment of Target Ligandability
Molly Chilton et al.
JOURNAL OF MEDICINAL CHEMISTRY (2017)
Discovery and Pharmacological Characterization of JNJ-42756493 (Erdafitinib), a Functionally Selective Small-Molecule FGFR Family Inhibitor
Timothy P. S. Perera et al.
MOLECULAR CANCER THERAPEUTICS (2017)
Unraveling self-assembly pathways of the 468-kDa proteolytic machine TET2
Pavel Macek et al.
SCIENCE ADVANCES (2017)
SPR-based fragment screening with neurotensin receptor 1 generates novel small molecule ligands
Sylwia Huber et al.
PLOS ONE (2017)
Fragment Binding to β-Secretase 1 without Catalytic Aspartate Interactions Identified via Orthogonal Screening Approaches
Frederik J. R. Rombouts et al.
ACS OMEGA (2017)
Opportunity Knocks: Organic Chemistry for Fragment-Based Drug Discovery (FBDD)
Christopher W. Murray et al.
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2016)
Developments in SPR Fragment Screening
Alain Chavanieu et al.
EXPERT OPINION ON DRUG DISCOVERY (2016)
Design Principles for Fragment Libraries: Maximizing the Value of Learnings from Pharma Fragment-Based Drug Discovery (FBDD) Programs for Use in Academia
Gyoergy M. Keseru et al.
JOURNAL OF MEDICINAL CHEMISTRY (2016)
Biophysics in drug discovery: impact, challenges and opportunities
Jean-Paul Renaud et al.
NATURE REVIEWS DRUG DISCOVERY (2016)
Twenty years on: the impact of fragments on drug discovery
Daniel A. Erlanson et al.
NATURE REVIEWS DRUG DISCOVERY (2016)
NMR in drug discovery: A practical guide to identification and validation of ligands interacting with biological macromolecules
Alvar D. Gossert et al.
PROGRESS IN NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY (2016)
Discovery of New Bromodomain Scaffolds by Biosensor Fragment Screening
Iva Navratilova et al.
ACS MEDICINAL CHEMISTRY LETTERS (2016)
Structure-Guided Blockade of CSF1R Kinase in Tenosynovial Giant-Cell Tumor
W. D. Tap et al.
NEW ENGLAND JOURNAL OF MEDICINE (2015)
Chemical con artists foil drug discovery
Jonathan Baell et al.
NATURE (2014)
The cellular thermal shift assay for evaluating drug target interactions in cells
Rozbeh Jafari et al.
NATURE PROTOCOLS (2014)
Efficient exploration of chemical space by fragment-based screening
Richard J. Hall et al.
PROGRESS IN BIOPHYSICS & MOLECULAR BIOLOGY (2014)
Fragment screening by SPR and advanced application to GPCRs
Claire A. Shepherd et al.
PROGRESS IN BIOPHYSICS & MOLECULAR BIOLOGY (2014)
Learning from our mistakes: The 'unknown knowns' in fragment screening
Ben J. Davis et al.
BIOORGANIC & MEDICINAL CHEMISTRY LETTERS (2013)
Design and pharmacology of a highly specific dual FMS and KIT kinase inhibitor
Chao Zhang et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2013)
Using chemical shift perturbation to characterise ligand binding
Mike P. Williamson
PROGRESS IN NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY (2013)
Monitoring Drug Target Engagement in Cells and Tissues Using the Cellular Thermal Shift Assay
Daniel Martinez Molina et al.
SCIENCE (2013)
Fluorine local environment: from screening to drug design
Anna Vulpetti et al.
DRUG DISCOVERY TODAY (2012)
Enumeration of 166 Billion Organic Small Molecules in the Chemical Universe Database GDB-17
Lars Ruddigkeit et al.
JOURNAL OF CHEMICAL INFORMATION AND MODELING (2012)
Quantitative Analysis of Multisite Protein-Ligand Interactions by NMR: Binding of Intrinsically Disordered p53 Transactivation Subdomains with the TAZ2 Domain of CBP
Munehito Arai et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2012)
Raise standards for preclinical cancer research
C. Glenn Begley et al.
NATURE (2012)
Experiences in fragment-based drug discovery
Christopher W. Murray et al.
TRENDS IN PHARMACOLOGICAL SCIENCES (2012)
Comparative Assessment of Different Histidine-Tags for Immobilization of Protein onto Surface Plasmon Resonance Sensorchips
Marcus Fischer et al.
ANALYTICAL CHEMISTRY (2011)
NMR Screening and Hit Validation in Fragment Based Drug Discovery
Ramon Campos-Olivas
CURRENT TOPICS IN MEDICINAL CHEMISTRY (2011)
A comparative study of fragment screening methods on the p38α kinase: new methods, new insights
Scott J. Pollack et al.
JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN (2011)
Believe it or not: how much can we rely on published data on potential drug targets?
Florian Prinz et al.
NATURE REVIEWS DRUG DISCOVERY (2011)
Experimental Validation of a Fragment Library for Lead Discovery Using SPR Biosensor Technology
Malin Elinder et al.
JOURNAL OF BIOMOLECULAR SCREENING (2011)
New Substructure Filters for Removal of Pan Assay Interference Compounds (PAINS) from Screening Libraries and for Their Exclusion in Bioassays
Jonathan B. Baell et al.
JOURNAL OF MEDICINAL CHEMISTRY (2010)
Clinical efficacy of a RAF inhibitor needs broad target blockade in BRAF-mutant melanoma
Gideon Bollag et al.
NATURE (2010)
Fragment Screening by Surface Plasmon Resonance
Iva Navratilova et al.
ACS MEDICINAL CHEMISTRY LETTERS (2010)
Surface plasmon resonance for high-throughput ligand screening of membrane-bound proteins
Jennifer A. Maynard et al.
Biotechnology Journal (2009)
NMR methods in fragment screening: theory and a comparison with other biophysical techniques
Claudio Dalvit
DRUG DISCOVERY TODAY (2009)
Fragment-Based Screening Using Surface Plasmon Resonance Technology
Samantha Perspicace et al.
JOURNAL OF BIOMOLECULAR SCREENING (2009)
Electronic Referencing Techniques for Quantitative NMR: Pitfalls and How To Avoid Them Using Amplitude-Corrected Referencing through Signal Injection
Knut Mehr et al.
ANALYTICAL CHEMISTRY (2008)
A quantitative model of thermal stabilization and destabilization of proteins by ligands
Piotras Cimmperman et al.
BIOPHYSICAL JOURNAL (2008)
Discovery of a selective inhibitor of oncogenic B-Raf kinase with potent antimelanoma activity
James Tsai et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2008)
Microscale fluorescent thermal stability assay for membrane proteins
Alexander I. Alexandrov et al.
STRUCTURE (2008)
NMR methods for the determination of protein-ligand dissociation constants
Lee Fielding
PROGRESS IN NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY (2007)
Fragment-based screening using X-ray crystallography and NMR spectroscopy
Harren Jhoti et al.
CURRENT OPINION IN CHEMICAL BIOLOGY (2007)
Quantitative dynamics and binding studies of the 20S proteasome by NMR
Remco Sprangers et al.
NATURE (2007)
The use of differential scanning fluorimetry to detect ligand interactions that promote protein stability
Frank H. Niesen et al.
NATURE PROTOCOLS (2007)
Effective rotational correlation times of proteins from NMR relaxation interference
D Lee et al.
JOURNAL OF MAGNETIC RESONANCE (2006)
Sensitivity improvement in 19F NMR-based screening experiments:: Theoretical considerations and experimental applications
C Dalvit et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2005)
Quantitative NMR spectroscopy - Applications in drug analysis
U Holzgrabe et al.
JOURNAL OF PHARMACEUTICAL AND BIOMEDICAL ANALYSIS (2005)
An inhibitor of Bcl-2 family proteins induces regression of solid tumours
T Oltersdorf et al.
NATURE (2005)
Thermodynamic stability of carbonic anhydrase: Measurements of binding affinity and stoichiometry using ThermoFluor
D Matulis et al.
BIOCHEMISTRY (2005)
Decrypting the biochemical function of an essential gene from Streptococcus pneumoniae using ThermoFluor® technology
TE Carver et al.
JOURNAL OF BIOLOGICAL CHEMISTRY (2005)
Fragment-based lead discovery using X-ray crystallography
MJ Hartshorn et al.
JOURNAL OF MEDICINAL CHEMISTRY (2005)
Allosteric inhibition through core disruption
JR Horn et al.
JOURNAL OF MOLECULAR BIOLOGY (2004)
An isotope labeling strategy for methyl TROSY spectroscopy
V Tugarinov et al.
JOURNAL OF BIOMOLECULAR NMR (2004)
Evaluation of fluorescence-based thermal shift assays for hit identification in drug discovery
MC Lo et al.
ANALYTICAL BIOCHEMISTRY (2004)
Using NMR for ligand discovery and optimization
HO Villar et al.
CURRENT OPINION IN CHEMICAL BIOLOGY (2004)
Theory and applications of NMR-based screening in pharmaceutical research
CA Lepre et al.
CHEMICAL REVIEWS (2004)
Exploring the limits of broadband excitation and inversion pulses
K Kobzar et al.
JOURNAL OF MAGNETIC RESONANCE (2004)
Present and future of surface plasmon resonance biosensors
J Homola
ANALYTICAL AND BIOANALYTICAL CHEMISTRY (2003)
Cross-correlated relaxation enhanced 1H-13C NMR spectroscopy of methyl groups in very high molecular weight proteins and protein complexes
V Tugarinov et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2003)
Stabilization of proteins by ligand binding: Application to drug screening and determination of unfolding energetics
TT Waldron et al.
BIOCHEMISTRY (2003)
Design of small molecule libraries for NMR screening and other applications in drug discovery
E Jacoby et al.
CURRENT TOPICS IN MEDICINAL CHEMISTRY (2003)
High-density miniaturized thermal shift assays as a general strategy for drug discovery
MW Pantoliano et al.
JOURNAL OF BIOMOLECULAR SCREENING (2001)
WaterLOGSY as a method for primary NMR screening: Practical aspects and range of applicability
C Dalvit et al.
JOURNAL OF BIOMOLECULAR NMR (2001)
Molecular complexity and its impact on the probability of finding leads for drug discovery
MM Hann et al.
JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES (2001)
Identification of compounds with binding affinity to proteins via magnetization transfer from bulk water
C Dalvit et al.
JOURNAL OF BIOMOLECULAR NMR (2000)