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The biased apelin receptor agonist, MM07, reverses Sugen/hypoxia-induced pulmonary arterial hypertension as effectively as the endothelin antagonist macitentan.
- Published in:
- Frontiers in Pharmacology, 2024, p. 1, doi. 10.3389/fphar.2024.1369489
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- Publication type:
- Article
Regulation of blood–brain barrier integrity by microbiome-associated methylamines and cognition by trimethylamine N-oxide.
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- Microbiome, 2021, v. 9, n. 1, p. 1, doi. 10.1186/s40168-021-01181-z
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- Publication type:
- Article
Regulation of blood–brain barrier integrity by microbiome-associated methylamines and cognition by trimethylamine N-oxide.
- Published in:
- Microbiome, 2021, v. 9, n. 1, p. 1, doi. 10.1186/s40168-021-01181-z
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- Publication type:
- Article
G392E neuroserpin causing the dementia FENIB is secreted from cells but is not synaptotoxic.
- Published in:
- Scientific Reports, 2021, v. 11, n. 1, p. 1, doi. 10.1038/s41598-021-88090-1
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- Publication type:
- Article
The G Protein Biased Small Molecule Apelin Agonist CMF-019 is Disease Modifying in Endothelial Cell Apoptosis In Vitro and Induces Vasodilatation Without Desensitisation In Vivo.
- Published in:
- Frontiers in Pharmacology, 2021, v. 11, p. N.PAG, doi. 10.3389/fphar.2020.588669
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- Publication type:
- Article
Extraction and Integration of Genetic Networks from Short-Profile Omic Data Sets.
- Published in:
- Metabolites (2218-1989), 2020, v. 10, n. 11, p. 435, doi. 10.3390/metabo10110435
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- Publication type:
- Article
Validating the validation: reanalyzing a large-scale comparison of deep learning and machine learning models for bioactivity prediction.
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- Journal of Computer-Aided Molecular Design, 2020, v. 34, n. 7, p. 717, doi. 10.1007/s10822-019-00274-0
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- Publication type:
- Article
Apelin peptides linked to anti‐serum albumin domain antibodies retain affinity in vitro and are efficacious receptor agonists in vivo.
- Published in:
- Basic & Clinical Pharmacology & Toxicology, 2020, v. 126, p. 96, doi. 10.1111/bcpt.13227
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- Publication type:
- Article
The nPYc-Toolbox, a Python module for the pre-processing, quality-control and analysis of metabolic profiling datasets.
- Published in:
- Bioinformatics, 2019, v. 35, n. 24, p. 5359, doi. 10.1093/bioinformatics/btz566
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- Publication type:
- Article
A Bone Morphogenetic Protein (BMP)-derived Peptide Based on the Type I Receptor-binding Site Modifies Cell-type Dependent BMP Signalling.
- Published in:
- Scientific Reports, 2019, v. 9, n. 1, p. N.PAG, doi. 10.1038/s41598-019-49758-x
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- Publication type:
- Article
The structural basis for membrane assembly of immunoreceptor signalling complexes.
- Published in:
- Journal of Molecular Modeling, 2019, v. 25, n. 9, p. N.PAG, doi. 10.1007/s00894-019-4165-6
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- Publication type:
- Article
A novel cyclic biased agonist of the apelin receptor, MM07, is disease modifying in the rat monocrotaline model of pulmonary arterial hypertension.
- Published in:
- 2019
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- Publication type:
- journal article
SPUTNIK: an R package for filtering of spatially related peaks in mass spectrometry imaging data.
- Published in:
- Bioinformatics, 2019, v. 35, n. 1, p. 178, doi. 10.1093/bioinformatics/bty622
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- Publication type:
- Article
Microbiome--host systems interactions: protective effects of propionate upon the blood--brain barrier.
- Published in:
- Microbiome, 2018, v. 6, p. 1, doi. 10.1186/s40168-018-0439-y
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- Publication type:
- Article
Pharmacological targeting of apelin impairs glioblastoma growth.
- Published in:
- 2017
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- Publication type:
- journal article
[Pyr¹]Apelin-13<sub>(1-12)</sub> Is a Biologically Active ACE2 Metabolite of the Endogenous Cardiovascular Peptide [Pyr¹]Apelin-13.
- Published in:
- Frontiers in Neuroscience, 2017, v. 11, p. 1, doi. 10.3389/fnins.2017.00092
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- Publication type:
- Article
Improving the prediction of organism-level toxicity through integration of chemical, protein target and cytotoxicity qHTS data.
- Published in:
- Toxicology Research, 2016, v. 5, n. 3, p. 883, doi. 10.1039/c5tx00406c
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- Publication type:
- Article
A note on utilising binary features as ligand descriptors.
- Published in:
- Journal of Cheminformatics, 2015, v. 7, p. 1, doi. 10.1186/s13321-015-0105-3
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- Publication type:
- Article
Cheminformatics Research at the Unilever Centre for Molecular Science Informatics Cambridge.
- Published in:
- Molecular Informatics, 2015, v. 34, n. 9, p. 626, doi. 10.1002/minf.201400166
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- Publication type:
- Article
Chemically Aware Model Builder (camb): an R package for property and bioactivity modelling of small molecules.
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- Journal of Cheminformatics, 2015, v. 7, n. 1, p. 1, doi. 10.1186/s13321-015-0086-2
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- Publication type:
- Article
A multi-label approach to target prediction taking ligand promiscuity into account.
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- Journal of Cheminformatics, 2015, v. 7, n. 1, p. 1, doi. 10.1186/s13321-015-0071-9
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- Publication type:
- Article
Metrabase: a cheminformatics and bioinformatics database for small molecule transporter data analysis and (Q)SAR modeling.
- Published in:
- Journal of Cheminformatics, 2015, v. 7, n. 1, p. 1, doi. 10.1186/s13321-015-0083-5
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- Publication type:
- Article
Verifying the fully "Laplacianised" posterior Naïve Bayesian approach and more.
- Published in:
- Journal of Cheminformatics, 2015, v. 7, n. 1, p. 1, doi. 10.1186/s13321-015-0075-5
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- Publication type:
- Article
Predicting drug metabolism: experiment and/or computation?
- Published in:
- Nature Reviews Drug Discovery, 2015, v. 14, n. 6, p. 387, doi. 10.1038/nrd4581
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- Publication type:
- Article
A combination of computational and experimental approaches identifies DNA sequence constraints associated with target site binding specificity of the transcription factor CSL.
- Published in:
- Nucleic Acids Research, 2014, v. 42, n. 16, p. 10550, doi. 10.1093/nar/gku730
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- Publication type:
- Article
Cytochrome P450 site of metabolism prediction from 2D topological fingerprints using GPU accelerated probabilistic classifiers.
- Published in:
- Journal of Cheminformatics, 2014, v. 6, n. 1, p. 1, doi. 10.1186/1758-2946-6-29
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- Publication type:
- Article
Investigating and Predicting how Biology Changes Molecules and Their Properties.
- Published in:
- Molecular Informatics, 2014, v. 33, n. 6/7, p. 443, doi. 10.1002/minf.201400031
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- Publication type:
- Article
Full "Laplacianised" posterior naive Bayesian algorithm.
- Published in:
- Journal of Cheminformatics, 2013, v. 5, n. 1, p. 1, doi. 10.1186/1758-2946-5-37
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- Publication type:
- Article
Diversity Selection of Compounds Based on 'Protein Affinity Fingerprints' Improves Sampling of Bioactive Chemical Space.
- Published in:
- Chemical Biology & Drug Design, 2013, v. 82, n. 3, p. 252, doi. 10.1111/cbdd.12155
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- Publication type:
- Article
Quantifying the shifts in physicochemical property space introduced by the metabolism of small organic molecules.
- Published in:
- Journal of Cheminformatics, 2013, v. 5, n. S1, p. 1, doi. 10.1186/1758-2946-5-S1-O12
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- Publication type:
- Article
Relating GPCRs pharmacological space based on ligands chemical similaritiess.
- Published in:
- 2013
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- Publication type:
- Conference Paper
Annotating targets with pathways: extending approaches to mode of action analysis.
- Published in:
- 2013
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- Publication type:
- Conference Paper
Probability Based hERG Blocker Classifiers.
- Published in:
- Molecular Informatics, 2012, v. 31, n. 9, p. 679, doi. 10.1002/minf.201200011
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- Publication type:
- Article
Winnow based identification of potent hERG inhibitors in silico: comparative assessment on different datasets.
- Published in:
- 2012
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- Publication type:
- Abstract
Probabilistic classifier: generated using randomised sub-sampling of the feature space.
- Published in:
- 2012
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- Publication type:
- Abstract
Discovery of a Competitive Apelin Receptor (APJ) Antagonist.
- Published in:
- ChemMedChem, 2011, v. 6, n. 6, p. 1017, doi. 10.1002/cmdc.201100069
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- Publication type:
- Article
Development and Comparison of hERG Blocker Classifiers: Assessment on Different Datasets Yields Markedly Different Results.
- Published in:
- Molecular Informatics, 2011, v. 30, n. 5, p. 443, doi. 10.1002/minf.201000159
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- Publication type:
- Article
Use of historic metabolic biotransformation data asa means of anticipating metabolic sites usingMetaPrint2D and Bioclipse.
- Published in:
- BMC Bioinformatics, 2010, v. 11, p. 362, doi. 10.1186/1471-2105-11-362
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- Publication type:
- Article
Erratum: A crowdsourcing evaluation of the NIH chemical probes.
- Published in:
- 2009
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- Publication type:
- Correction notice
A crowdsourcing evaluation of the NIH chemical probes.
- Published in:
- Nature Chemical Biology, 2009, v. 5, n. 7, p. 441, doi. 10.1038/nchembio0709-441
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- Publication type:
- Article
Support vector inductive logic programming outperforms the naive Bayes classifier and inductive logic programming for the classification of bioactive chemical compounds.
- Published in:
- Journal of Computer-Aided Molecular Design, 2007, v. 21, n. 5, p. 269, doi. 10.1007/s10822-007-9113-3
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- Publication type:
- Article
A new method for the reproducible generation of polymorphs: two forms of sulindac with very different solubilities.
- Published in:
- Journal of Applied Crystallography, 2007, v. 40, n. 2, p. 379, doi. 10.1107/S0021889807007832
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- Publication type:
- Article
Quantifying the complexity of chaos in multibasin multidimensional dynamics of molecular systems.
- Published in:
- Complexity, 2004, v. 10, n. 2, p. 40, doi. 10.1002/cplx.20055
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- Publication type:
- Article
VESPA: A new, fast approach to electrostatic potential-derived atomic charges from semiempirical methods.
- Published in:
- Journal of Computational Chemistry, 1997, v. 18, n. 6, p. 744, doi. 10.1002/(SICI)1096-987X(19970430)18:6<744::AID-JCC2>3.0.CO;2-S
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- Publication type:
- Article
Synthesis and Platelet Aggregation Inhibiting Activity of Acid Side-chain Modified Hydantoin Prostaglandin Analogues.
- Published in:
- Archiv der Pharmazie, 1993, v. 326, n. 2, p. 85, doi. 10.1002/ardp.19933260206
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- Publication type:
- Article