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Validation of a homology model of Mycobacterium tuberculosis DXS: rationalization of observed activities of thiamine derivatives as potent inhibitors of two orthologues of DXS

Organic & biomolecular chemistry, 2015-01, Vol.13 (46), p.11263-11277

2015

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Citraconate inhibits ACOD1 (IRG1) catalysis, reduces interferon responses and oxidative stress, and modulates inflammation and cell metabolism

Nature metabolism, 2022-05, Vol.4 (5), p.534-546

2022

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Identification of N,N-arylalkyl-picolinamide derivatives targeting the RNA-binding protein HuR, by combining biophysical fragment-screening and molecular hybridization

Bioorganic chemistry, 2021-11, Vol.116, p.105305-105305, Article 105305

2021

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Insight into the complete substrate-binding pocket of ThiT by chemical and genetic mutations

MedChemComm, 2017-05, Vol.8 (5), p.1121-1130

2017

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De novo fragment-based design of inhibitors of DXS guided by spin-diffusion-based NMR spectroscopy

Chemical science (Cambridge), 2014, Vol.5 (9), p.3543-3551

2014

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Validation of a homology model of Mycobacterium tuberculosis DXS: rationalization of observed activities of thiamine derivatives as potent inhibitors of two orthologues of DXSElectronic supplementary information (ESI) available: Figures of the modeled binding modes, Ramachandran plot of the homology model, NMR spectra and HPLC chromatograms. See DOI: 10.1039/c5ob01666e

2015-11

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Design and synthesis of thiamine analogues to study their binding to the ECF transporter for thiamine in bacteria

MedChemComm, 2016-01, Vol.7 (5), p.966-971

2016

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Insight into the complete substrate-binding pocket of ThiT by chemical and genetic mutationsThe authors declare no competing interests.Electronic supplementary information (ESI) available: Synthesis and characterization of compounds, including images of NMR spectra. See DOI: 10.1039/c7md00079k

2017-05

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Design and synthesis of thiamine analogues to study their binding to the ECF transporter for thiamine in bacteriaThe authors declare no competing interests.Electronic supplementary information (ESI) available: Spectra and HPLC chromatograms of compounds 3-7. See DOI: 10.1039/c6md00022c

2016-05

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Insight into the complete substrate-binding pocket of ThiT by chemical and genetic mutations† †The authors declare no competing interests. ‡ ‡Electronic supplementary information (ESI) available: Synthesis and characterization of compounds, including images of NMR spectra. See DOI: 10.1039/c7md00079k

MedChemComm, 2017-03, Vol.8 (5), p.1121-1130

2017

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The VNR Concise Encyclopedia of Mathematics

1, 1977

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Dynamic combinatorial chemistry: a tool to facilitate the identification of inhibitors for protein targets

Chemical Society reviews, 2015-04, Vol.44 (8), p.2455-2488

2015

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Molecular Biodynamers: Dynamic Covalent Analogues of Biopolymers

Accounts of chemical research, 2017-02, Vol.50 (2), p.376-386

2017

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Concepts and Core Principles of Fragment-Based Drug Design

Molecules (Basel, Switzerland), 2019-11, Vol.24 (23), p.4309

2019

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PD-L1 expression in nonclear-cell renal cell carcinoma

Annals of oncology, 2014-11, Vol.25 (11), p.2178-2184

2014

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The Structure of the First Coordination Shell in Liquid Water

Science (American Association for the Advancement of Science), 2004-05, Vol.304 (5673), p.995-999

2004

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Development of Inhibitors of the 2C‑Methyl‑d‑erythritol 4‑Phosphate (MEP) Pathway Enzymes as Potential Anti-Infective Agents

Journal of medicinal chemistry, 2014-12, Vol.57 (23), p.9740-9763

2014

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Primary ex vivo cultures of human fallopian tube epithelium as a model for serous ovarian carcinogenesis

Oncogene, 2010-02, Vol.29 (8), p.1103-1113

2010

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Malignant CTA Collateral Profile Is Highly Specific for Large Admission DWI Infarct Core and Poor Outcome in Acute Stroke

American journal of neuroradiology : AJNR, 2012-08, Vol.33 (7), p.1331-1336

2012

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BK Polyomavirus Replication in Renal Tubular Epithelial Cells Is Inhibited by Sirolimus, but Activated by Tacrolimus Through a Pathway Involving FKBP‐12

American journal of transplantation, 2016-03, Vol.16 (3), p.821-832

2016

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NRF2 activators inhibit influenza A virus replication by interfering with nucleo-cytoplasmic export of viral RNPs in an NRF2-independent manner

PLoS pathogens, 2023-07, Vol.19 (7), p.e1011506-e1011506

2023

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From Wood to Tetrahydro-2-benzazepines in Three Waste-Free Steps: Modular Synthesis of Biologically Active Lignin-Derived Scaffolds

ACS central science, 2019-10, Vol.5 (10), p.1707-1716

2019

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Phosphate Recognition in Structural Biology

Angewandte Chemie International Edition, 2007-01, Vol.46 (3), p.338-352

2007

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SARS-CoV-2 outbreak in a tri-national urban area is dominated by a B.1 lineage variant linked to a mass gathering event

PLoS pathogens, 2021-03, Vol.17 (3), p.e1009374-e1009374

2021

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Validation of a homology model of Mycobacterium tuberculosis DXS: rationalization of observed activities of thiamine derivatives as potent inhibitors of two orthologues of DXS

Citraconate inhibits ACOD1 (IRG1) catalysis, reduces interferon responses and oxidative stress, and modulates inflammation and cell metabolism

Identification of N,N-arylalkyl-picolinamide derivatives targeting the RNA-binding protein HuR, by combining biophysical fragment-screening and molecular hybridization

Insight into the complete substrate-binding pocket of ThiT by chemical and genetic mutations

De novo fragment-based design of inhibitors of DXS guided by spin-diffusion-based NMR spectroscopy

Design and synthesis of thiamine analogues to study their binding to the ECF transporter for thiamine in bacteria

Insight into the complete substrate-binding pocket of ThiT by chemical and genetic mutationsThe authors declare no competing interests.Electronic supplementary information (ESI) available: Synthesis and characterization of compounds, including images of NMR spectra. See DOI: 10.1039/c7md00079k

Design and synthesis of thiamine analogues to study their binding to the ECF transporter for thiamine in bacteriaThe authors declare no competing interests.Electronic supplementary information (ESI) available: Spectra and HPLC chromatograms of compounds 3-7. See DOI: 10.1039/c6md00022c

The VNR Concise Encyclopedia of Mathematics

Dynamic combinatorial chemistry: a tool to facilitate the identification of inhibitors for protein targets

Molecular Biodynamers: Dynamic Covalent Analogues of Biopolymers

Concepts and Core Principles of Fragment-Based Drug Design

PD-L1 expression in nonclear-cell renal cell carcinoma

The Structure of the First Coordination Shell in Liquid Water

Development of Inhibitors of the 2C‑Methyl‑d‑erythritol 4‑Phosphate (MEP) Pathway Enzymes as Potential Anti-Infective Agents

Primary ex vivo cultures of human fallopian tube epithelium as a model for serous ovarian carcinogenesis

Malignant CTA Collateral Profile Is Highly Specific for Large Admission DWI Infarct Core and Poor Outcome in Acute Stroke

BK Polyomavirus Replication in Renal Tubular Epithelial Cells Is Inhibited by Sirolimus, but Activated by Tacrolimus Through a Pathway Involving FKBP‐12

NRF2 activators inhibit influenza A virus replication by interfering with nucleo-cytoplasmic export of viral RNPs in an NRF2-independent manner

Progressive immune dysfunction with advancing disease stage in renal cell carcinoma

From Wood to Tetrahydro-2-benzazepines in Three Waste-Free Steps: Modular Synthesis of Biologically Active Lignin-Derived Scaffolds

Phosphate Recognition in Structural Biology

SARS-CoV-2 outbreak in a tri-national urban area is dominated by a B.1 lineage variant linked to a mass gathering event

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