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Small molecule inhibitors of the LEDGF site of human immunodeficiency virus integrase identified by fragment screening and structure based design

PloS one, 2012-07, Vol.7 (7), p.e40147-e40147

2012

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Parallel screening of low molecular weight fragment libraries: do differences in methodology affect hit identification?

Journal of biomolecular screening, 2013-02, Vol.18 (2), p.147-159

2013

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Design of a series of bicyclic HIV-1 integrase inhibitors. Part 2: Azoles: Effective metal chelators

Bioorganic & medicinal chemistry letters, 2010-10, Vol.20 (19), p.5909-5912

2010

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Interrogating HIV integrase for compounds that bind- a SAMPL challenge

Journal of computer-aided molecular design, 2014-04, Vol.28 (4), p.347-362

2014

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Microwave-mediated synthesis and manipulation of a 2-substituted-5-aminooxazole-4-carbonitrile library

Tetrahedron letters, 2012-03, Vol.53 (13), p.1656-1659

2012

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Synthesis and solid state study of pyridine- and pyrimidine-based fragment libraries

Tetrahedron letters, 2011-11, Vol.52 (45), p.5905-5909

2011

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Crystal Structures of Novel Allosteric Peptide Inhibitors of HIV Integrase Identify New Interactions at the LEDGF Binding Site

Chembiochem : a European journal of chemical biology, 2011-10, Vol.12 (15), p.2311-2315

2011

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Design of a series of bicyclic HIV-1 integrase inhibitors. Part 1: Selection of the scaffold

Bioorganic & medicinal chemistry letters, 2010-10, Vol.20 (19), p.5913-5917

2010

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Fragment-Based Design of Ligands Targeting a Novel Site on the Integrase Enzyme of Human Immunodeficiency Virus 1

ChemMedChem, 2011-02, Vol.6 (2), p.258-261

2011

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Structural basis for a new mechanism of inhibition of HIV-1 integrase identified by fragment screening and structure-based design

Antiviral chemistry & chemotherapy, 2011-03, Vol.21 (4), p.155-168

2011

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The unexpected but predictable tetrazole packing in flexible 1-benzyl-1H-tetrazole

CrystEngComm, 2012-01, Vol.14 (20), p.6441-6446

2012

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Discovery of potent HIV integrase inhibitors active against raltegravir resistant viruses

Bioorganic & medicinal chemistry letters, 2010-09, Vol.20 (17), p.5013-5018

2010

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A New Process for Synthesis of Apricitabine, 2-(R)-Hydroxymethyl-4-(R)-(cytosin-1′-yl)-1,3-oxathiolane, an Anti-HIV NRTI

Organic process research & development, 2011-07, Vol.15 (4), p.763-773

2011

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Generation of Ligand Conformations in Continuum Solvent Consistent with Protein Active Site Topology: Application to Thrombin

Journal of medicinal chemistry, 2003-04, Vol.46 (8), p.1293-1305

2003

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Assembly of Urokinase Receptor-Mediated Plasminogen Activation Complexes Involves Direct, Non-Active-Site Interactions between Urokinase and Plasminogen

Biochemistry (Easton), 1999-01, Vol.38 (2), p.651-659

1999

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Characterization of a Class of Peptide Boronates with Neutral P1 Side Chains as Highly Selective Inhibitors of Thrombin

Journal of medicinal chemistry, 1995-04, Vol.38 (9), p.1511-1522

1995

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Bifunctional Peptide Boronate Inhibitors of Thrombin: Crystallographic Analysis of Inhibition Enhanced by Linkage to an Exosite 1 Binding Peptide

Biochemistry (Easton), 1998-10, Vol.37 (41), p.14420-14427

1998

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Crystallographic Structures of Human α-Thrombin Complexed to Peptide Boronic Acids Lacking a Positive Charge at P1. Evidence of Novel Interactions

Journal of the American Chemical Society, 1997-10, Vol.119 (41), p.9935-9936

1997

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Fragment-Based Design of Ligands Targeting a Novel Site on the Integrase Enzyme of Human Immunodeficiency Virus;#8197;1

ChemMedChem, 2011-08, Vol.6 ((2) ; 02, 2011)

2011

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Crystal Structures of Two Palladacycles from the C–H Activation of 2-(Thiophen-2-yl)pyridine

Journal of chemical crystallography, 2011-04, Vol.41 (4), p.523-527

2011

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Corrigendum: Fragment-Based Design of Ligands Targeting a Novel Site on the Integrase Enzyme of Human Immunodeficiency Virus 1

ChemMedChem, 2011-04, Vol.6 (4), p.583-583

2011

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Hydroxyperfluoroazobenzenes: novel inhibitors of enzymes of androgen biosynthesis

Journal of medicinal chemistry, 1990-09, Vol.33 (9), p.2452-2455

1990

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Inhibition of human alpha-thrombin by a phosphonate tripeptide proceeds via a metastable pentacoordinated phosphorus intermediate

Journal of molecular biology, 2001-08, Vol.311 (3), p.549-555

2001

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Synthesis of para-Substituted 3-Formyl Arylboronic Esters

Synthesis (Stuttgart), 2002, Vol.2002 (16), p.2379-2382

2002

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Small molecule inhibitors of the LEDGF site of human immunodeficiency virus integrase identified by fragment screening and structure based design

Parallel screening of low molecular weight fragment libraries: do differences in methodology affect hit identification?

Design of a series of bicyclic HIV-1 integrase inhibitors. Part 2: Azoles: Effective metal chelators

Correction: Small Molecule Inhibitors of the LEDGF Site of Human Immunodeficiency Virus Integrase Identified by Fragment Screening and Structure Based Design

Interrogating HIV integrase for compounds that bind- a SAMPL challenge

Microwave-mediated synthesis and manipulation of a 2-substituted-5-aminooxazole-4-carbonitrile library

Synthesis and solid state study of pyridine- and pyrimidine-based fragment libraries

Crystal Structures of Novel Allosteric Peptide Inhibitors of HIV Integrase Identify New Interactions at the LEDGF Binding Site

Design of a series of bicyclic HIV-1 integrase inhibitors. Part 1: Selection of the scaffold

Fragment-Based Design of Ligands Targeting a Novel Site on the Integrase Enzyme of Human Immunodeficiency Virus 1

Structural basis for a new mechanism of inhibition of HIV-1 integrase identified by fragment screening and structure-based design

The unexpected but predictable tetrazole packing in flexible 1-benzyl-1H-tetrazole

Discovery of potent HIV integrase inhibitors active against raltegravir resistant viruses

A New Process for Synthesis of Apricitabine, 2-(R)-Hydroxymethyl-4-(R)-(cytosin-1′-yl)-1,3-oxathiolane, an Anti-HIV NRTI

Generation of Ligand Conformations in Continuum Solvent Consistent with Protein Active Site Topology: Application to Thrombin

Assembly of Urokinase Receptor-Mediated Plasminogen Activation Complexes Involves Direct, Non-Active-Site Interactions between Urokinase and Plasminogen

Characterization of a Class of Peptide Boronates with Neutral P1 Side Chains as Highly Selective Inhibitors of Thrombin

Bifunctional Peptide Boronate Inhibitors of Thrombin: Crystallographic Analysis of Inhibition Enhanced by Linkage to an Exosite 1 Binding Peptide

Crystallographic Structures of Human α-Thrombin Complexed to Peptide Boronic Acids Lacking a Positive Charge at P1. Evidence of Novel Interactions

Fragment-Based Design of Ligands Targeting a Novel Site on the Integrase Enzyme of Human Immunodeficiency Virus;#8197;1

Crystal Structures of Two Palladacycles from the C–H Activation of 2-(Thiophen-2-yl)pyridine

Corrigendum: Fragment-Based Design of Ligands Targeting a Novel Site on the Integrase Enzyme of Human Immunodeficiency Virus 1

Hydroxyperfluoroazobenzenes: novel inhibitors of enzymes of androgen biosynthesis

Inhibition of human alpha-thrombin by a phosphonate tripeptide proceeds via a metastable pentacoordinated phosphorus intermediate

Synthesis of para-Substituted 3-Formyl Arylboronic Esters

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