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The global preclinical antibacterial pipeline

Nature reviews. Microbiology, 2020-05, Vol.18 (5), p.275-285

2020

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Docking of Macrocycles: Comparing Rigid and Flexible Docking in Glide

Journal of chemical information and modeling, 2017-02, Vol.57 (2), p.190-202

2017

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Conformational analysis of macrocycles: comparing general and specialized methods

Journal of computer-aided molecular design, 2020-03, Vol.34 (3), p.231-252

2020

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Discovery and preclinical development of new antibiotics

Upsala journal of medical sciences, 2014-05, Vol.119 (2), p.162-169

2014

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Virtual Screening Data Fusion Using Both Structure- and Ligand-Based Methods

Journal of chemical information and modeling, 2012-01, Vol.52 (1), p.225-232

2012

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ENABLE: an engine for European antibacterial drug discovery and development

Nature reviews. Drug discovery, 2021-06, Vol.20 (6), p.407-408

2021

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Predicting the Rate of Skin Penetration Using an Aggregated Conformal Prediction Framework

Molecular pharmaceutics, 2017-05, Vol.14 (5), p.1571-1576

2017

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Computational studies of molecular pre-organization through macrocyclization: Conformational distribution analysis of closely related non-macrocyclic and macrocyclic analogs

Bioorganic & medicinal chemistry, 2021-11, Vol.49, p.116399-116399, Article 116399

2021

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Bacterial type I signal peptidase inhibitors - Optimized hits from nature

European journal of medicinal chemistry, 2022-08, Vol.238, p.114490-114490, Article 114490

2022

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Antibacterial sulfonimidamide-based oligopeptides as type I signal peptidase inhibitors: Synthesis and biological evaluation

European journal of medicinal chemistry, 2021-11, Vol.224, p.113699-113699, Article 113699

2021

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Potent Macrocyclic Inhibitors of Insulin-Regulated Aminopeptidase (IRAP) by Olefin Ring-Closing Metathesis

Journal of medicinal chemistry, 2011-06, Vol.54 (11), p.3779-3792

2011

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Achiral Pyrazinone-Based Inhibitors of the Hepatitis C Virus NS3 Protease and Drug-Resistant Variants with Elongated Substituents Directed Toward the S2 Pocket

Journal of medicinal chemistry, 2014-03, Vol.57 (5), p.1790-1801

2014

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Disulfide Cyclized Tripeptide Analogues of Angiotensin IV as Potent and Selective Inhibitors of Insulin-Regulated Aminopeptidase (IRAP)

Journal of medicinal chemistry, 2010-11, Vol.53 (22), p.8059-8071

2010

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Trisubstituted Imidazoles as Mycobacterium tuberculosis Glutamine Synthetase Inhibitors

Journal of medicinal chemistry, 2012-03, Vol.55 (6), p.2894-2898

2012

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Toward a Benchmarking Data Set Able to Evaluate Ligand- and Structure-based Virtual Screening Using Public HTS Data

Journal of chemical information and modeling, 2015-02, Vol.55 (2), p.343-353

2015

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Synthesis of Functionalized Cinnamaldehyde Derivatives by an Oxidative Heck Reaction and Their Use as Starting Materials for Preparation of Mycobacterium tuberculosis 1-Deoxy-d-xylulose-5-phosphate Reductoisomerase Inhibitors

Journal of organic chemistry, 2011-11, Vol.76 (21), p.8986-8998

2011

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Design, Synthesis, and Biological Evaluation of the First Selective Nonpeptide AT2 Receptor Agonist

Journal of medicinal chemistry, 2004-11, Vol.47 (24), p.5995-6008

2004

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Design, synthesis, and in vitro biological evaluation of meta-sulfonamidobenzamide-based antibacterial LpxH inhibitors

European journal of medicinal chemistry, 2024-11, Vol.278, p.116790, Article 116790

2024

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Design, Synthesis, and X-ray Crystallographic Studies of α-Aryl Substituted Fosmidomycin Analogues as Inhibitors of Mycobacterium tuberculosis 1-Deoxy-d-xylulose 5-Phosphate Reductoisomerase

Journal of medicinal chemistry, 2011-07, Vol.54 (14), p.4964-4976

2011

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Antibiotic class with potent in vivo activity targeting lipopolysaccharide synthesis in Gram-negative bacteria

Proceedings of the National Academy of Sciences - PNAS, 2024-04, Vol.121 (15), p.e2317274121-e2317274121

2024

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Synthesis and In Vitro Biological Evaluation of Quinolinyl Pyrimidines Targeting Type II NADH-Dehydrogenase (NDH-2)

ACS infectious diseases, 2022-03, Vol.8 (3), p.482-498

2022

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DXR Inhibition by Potent Mono- and Disubstituted Fosmidomycin Analogues

Journal of medicinal chemistry, 2013-08, Vol.56 (15), p.6190-6199

2013

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Functionalized 3-amino-imidazo[1,2- a]pyridines: A novel class of drug-like Mycobacterium tuberculosis glutamine synthetase inhibitors

Bioorganic & medicinal chemistry letters, 2009-08, Vol.19 (16), p.4790-4793

2009

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Boronic ester-linked macrocyclic lipopeptides as serine protease inhibitors targeting Escherichia coli type I signal peptidase

European journal of medicinal chemistry, 2018-09, Vol.157, p.1346-1360

2018

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Identification of Plasmodium falciparum Spermidine Synthase Active Site Binders through Structure-Based Virtual Screening

Journal of medicinal chemistry, 2008-05, Vol.51 (9), p.2777-2786

2008

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The global preclinical antibacterial pipeline

Docking of Macrocycles: Comparing Rigid and Flexible Docking in Glide

Conformational analysis of macrocycles: comparing general and specialized methods

Discovery and preclinical development of new antibiotics

Virtual Screening Data Fusion Using Both Structure- and Ligand-Based Methods

ENABLE: an engine for European antibacterial drug discovery and development

Predicting the Rate of Skin Penetration Using an Aggregated Conformal Prediction Framework

Computational studies of molecular pre-organization through macrocyclization: Conformational distribution analysis of closely related non-macrocyclic and macrocyclic analogs

Bacterial type I signal peptidase inhibitors - Optimized hits from nature

Antibacterial sulfonimidamide-based oligopeptides as type I signal peptidase inhibitors: Synthesis and biological evaluation

Potent Macrocyclic Inhibitors of Insulin-Regulated Aminopeptidase (IRAP) by Olefin Ring-Closing Metathesis

Achiral Pyrazinone-Based Inhibitors of the Hepatitis C Virus NS3 Protease and Drug-Resistant Variants with Elongated Substituents Directed Toward the S2 Pocket

Disulfide Cyclized Tripeptide Analogues of Angiotensin IV as Potent and Selective Inhibitors of Insulin-Regulated Aminopeptidase (IRAP)

Trisubstituted Imidazoles as Mycobacterium tuberculosis Glutamine Synthetase Inhibitors

Toward a Benchmarking Data Set Able to Evaluate Ligand- and Structure-based Virtual Screening Using Public HTS Data

Synthesis of Functionalized Cinnamaldehyde Derivatives by an Oxidative Heck Reaction and Their Use as Starting Materials for Preparation of Mycobacterium tuberculosis 1-Deoxy-d-xylulose-5-phosphate Reductoisomerase Inhibitors

Design, Synthesis, and Biological Evaluation of the First Selective Nonpeptide AT2 Receptor Agonist

Design, synthesis, and in vitro biological evaluation of meta-sulfonamidobenzamide-based antibacterial LpxH inhibitors

Design, Synthesis, and X-ray Crystallographic Studies of α-Aryl Substituted Fosmidomycin Analogues as Inhibitors of Mycobacterium tuberculosis 1-Deoxy-d-xylulose 5-Phosphate Reductoisomerase

Antibiotic class with potent in vivo activity targeting lipopolysaccharide synthesis in Gram-negative bacteria

Synthesis and In Vitro Biological Evaluation of Quinolinyl Pyrimidines Targeting Type II NADH-Dehydrogenase (NDH-2)

DXR Inhibition by Potent Mono- and Disubstituted Fosmidomycin Analogues

Functionalized 3-amino-imidazo[1,2- a]pyridines: A novel class of drug-like Mycobacterium tuberculosis glutamine synthetase inhibitors

Boronic ester-linked macrocyclic lipopeptides as serine protease inhibitors targeting Escherichia coli type I signal peptidase

Identification of Plasmodium falciparum Spermidine Synthase Active Site Binders through Structure-Based Virtual Screening

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