Search Results - "Deadman, John J."

Small molecule inhibitors of the LEDGF site of human immunodeficiency virus integrase identified by fragment screening and structure based design by Peat, Thomas S, Rhodes, David I, Vandegraaff, Nick, Le, Giang, Smith, Jessica A, Clark, Lisa J, Jones, Eric D, Coates, Jonathan A V, Thienthong, Neeranat, Newman, Janet, Dolezal, Olan, Mulder, Roger, Ryan, John H, Savage, G Paul, Francis, Craig L, Deadman, John J

“…A fragment-based screen against human immunodeficiency virus type 1 (HIV) integrase led to a number of compounds that bound to the lens epithelium derived…”
Get full text

Parallel screening of low molecular weight fragment libraries: do differences in methodology affect hit identification? by Wielens, Jerome, Headey, Stephen J, Rhodes, David I, Mulder, Roger J, Dolezal, Olan, Deadman, John J, Newman, Janet, Chalmers, David K, Parker, Michael W, Peat, Thomas S, Scanlon, Martin J

“…Fragment screening is becoming widely accepted as a technique to identify hit compounds for the development of novel lead compounds. In neighboring…”
Get more information

Design of a series of bicyclic HIV-1 integrase inhibitors. Part 2: Azoles: Effective metal chelators by Le, Giang, Vandegraaff, Nick, Rhodes, David I., Jones, Eric D., Coates, Jonathan A.V., Thienthong, Neeranat, Winfield, Lisa J., Lu, Long, Li, Xinming, Yu, Changjiang, Feng, Xiao, Deadman, John J.

“…Synthesis of a diverse set of azoles and their utilizations as an amide isostere in the design of HIV integrase inhibitors is described. The Letter identified…”
Get full text

Correction: Small Molecule Inhibitors of the LEDGF Site of Human Immunodeficiency Virus Integrase Identified by Fragment Screening and Structure Based Design by Peat, Thomas S., Rhodes, David I., Vandegraaff, Nick, Le, Giang, Smith, Jessica A., Clark, Lisa J., Jones, Eric D., Coates, Jonathan A. V., Thienthong, Neeranat, Newman, Janet, Dolezal, Olan, Mulder, Roger, Ryan, John H., Savage, G. Paul, Francis, Craig L., Deadman, John J.

Get full text

Interrogating HIV integrase for compounds that bind- a SAMPL challenge by Peat, Thomas S., Dolezal, Olan, Newman, Janet, Mobley, David, Deadman, John J.

“…Tremendous gains and novel methods are often developed when people are challenged to do something new or difficult. This process is enhanced when people…”
Get full text

Microwave-mediated synthesis and manipulation of a 2-substituted-5-aminooxazole-4-carbonitrile library by Spencer, John, Patel, Hiren, Amin, Jahangir, Callear, Samantha K., Coles, Simon J., Deadman, John J., Furman, Christophe, Mansouri, Roxane, Chavatte, Philippe, Millet, Régis

“…A library of oxazoles is synthesised using parallel synthetic methodology. A 2-substituted-5-aminooxazole-4-carbonitrile library has been synthesised and…”
Get full text

Synthesis and solid state study of pyridine- and pyrimidine-based fragment libraries by Spencer, John, Patel, Hiren, Callear, Samantha K., Coles, Simon J., Deadman, John J.

“…A library of pyridines and pyrimidines has been synthesised in excellent yields employing microwave and flow chemistry methodologies. Work-up bottlenecks have…”
Get full text

Crystal Structures of Novel Allosteric Peptide Inhibitors of HIV Integrase Identify New Interactions at the LEDGF Binding Site by Rhodes, David I., Peat, Thomas S., Vandegraaff, Nick, Jeevarajah, Dharshini, Newman, Janet, Martyn, John, Coates, Jonathan A. V., Ede, Nicholas J., Rea, Philip, Deadman, John J.

“…An optimised method of solution cyclisation gave us access to a series of peptides including SLKIDNLD (2). We investigated the crystallographic complexes of…”
Get full text

Design of a series of bicyclic HIV-1 integrase inhibitors. Part 1: Selection of the scaffold by Jones, Eric D., Vandegraaff, Nick, Le, Giang, Choi, Neil, Issa, William, Macfarlane, Katherine, Thienthong, Neeranat, Winfield, Lisa J., Coates, Jonathan A.V., Lu, Long, Li, Xinming, Feng, Xiao, Yu, Changjiang, Rhodes, David I., Deadman, John J.

“…HIV integrase inhibitors based on a novel bicyclic pyrimidinone core is presented. Nine variations of the core scaffold are evaluated leading to optimization…”
Get full text

Fragment-Based Design of Ligands Targeting a Novel Site on the Integrase Enzyme of Human Immunodeficiency Virus 1 by Wielens, Jerome, Headey, Stephen J., Deadman, John J., Rhodes, David I., Parker, Michael W., Chalmers, David K., Scanlon, Martin J.

“…Every little bit counts! Fragment‐based screening has been used to identify a novel ligand binding site on HIV‐1 integrase. Crystal structures of fragments…”
Get full text

Structural basis for a new mechanism of inhibition of HIV-1 integrase identified by fragment screening and structure-based design by Rhodes, David I, Peat, Thomas S, Vandegraaff, Nick, Jeevarajah, Dharshini, Le, Giang, Jones, Eric D, Smith, Jessica A, Coates, Jonathan A V, Winfield, Lisa J, Thienthong, Neeranat, Newman, Janet, Lucent, Del, Ryan, John H, Savage, G Paul, Francis, Craig L, Deadman, John J

“…HIV-1 integrase is a clinically validated therapeutic target for the treatment of HIV-1 infection, with one approved therapeutic currently on the market. This…”
Get full text

Discovery of potent HIV integrase inhibitors active against raltegravir resistant viruses by Le, Giang, Vandegraaff, Nick, Rhodes, David I., Jones, Eric D., Coates, Jonathan A.V., Lu, Long, Li, Xinming, Yu, Changjiang, Feng, Xiao, Deadman, John J.

“…A series of novel HIV integrase inhibitors active against rategravir resistant strains are reported. Initial SAR studies revealed that activities against…”
Get full text

A New Process for Synthesis of Apricitabine, 2-(R)-Hydroxymethyl-4-(R)-(cytosin-1′-yl)-1,3-oxathiolane, an Anti-HIV NRTI by Marcuccio, Sebastian M, Epa, Ruwan, White, Jonathan M, Deadman, John J

“…Apricitabine is a novel inhibitor of the HIV virus reverse transcriptase polymerase which is currently in clinical development for the treatment of AIDS. A new…”
Get full text

Generation of Ligand Conformations in Continuum Solvent Consistent with Protein Active Site Topology:  Application to Thrombin by Greenidge, Paulette A, Mérette, Sandrine A. M, Beck, Richard, Dodson, Guy, Goodwin, Christopher A, Scully, Michael F, Spencer, John, Weiser, Jörg, Deadman, John J

“…Using the crystal structure of an inhibitor complexed with the serine protease thrombin (PDB code 1UVT) and the functional group definitions contained within…”
Get full text

Assembly of Urokinase Receptor-Mediated Plasminogen Activation Complexes Involves Direct, Non-Active-Site Interactions between Urokinase and Plasminogen by Ellis, Vincent, Whawell, Simon A, Werner, Finn, Deadman, John J

“…The binding of the zymogenic form of urokinase-type plasminogen activator (pro-uPA) to its specific cellular receptor, uPAR, leads to a large potentiation of…”
Get full text

Characterization of a Class of Peptide Boronates with Neutral P1 Side Chains as Highly Selective Inhibitors of Thrombin by Deadman, John J, Elgendy, Said, Goodwin, Christopher A, Green, Donovan, Baban, Jehan A, Patel, Geeta, Skordalakes, Emmanuel, Chino, Naoyoshi, Claeson, Goran

“…Z-D-Phe-Pro-boroMpg-OPin (9a)1,2 has been shown previously to be a highly specific inhibitor of thrombin in spite of lacking an arginine-like guanidino group…”
Get full text

Bifunctional Peptide Boronate Inhibitors of Thrombin:  Crystallographic Analysis of Inhibition Enhanced by Linkage to an Exosite 1 Binding Peptide by Skordalakes, Emmanuel, Elgendy, Said, Goodwin, Christopher A, Green, Donovan, Scully, Michael F, Kakkar, Vijay V, Freyssinet, Jean-Marie, Dodson, Guy, Deadman, John J

“…The affinity of the hirudin49-64 segment for exosite 1 of thrombin has been used previously to enhance the potency of simple competitive inhibitors [DiMaio,…”
Get full text

Crystallographic Structures of Human α-Thrombin Complexed to Peptide Boronic Acids Lacking a Positive Charge at P1. Evidence of Novel Interactions by Skordalakes, Emmanuel, Tyrell, Richard, Elgendy, Said, Goodwin, Christopher A, Green, Donovan, Dodson, Guy, Scully, Michael F, Freyssinet, Jean-Marie H, Kakkar, Vijay V, Deadman, John J

Get full text

Hydroxyperfluoroazobenzenes: novel inhibitors of enzymes of androgen biosynthesis by Jarman, Michael, Barrie, S. Elaine, Deadman, John J, Houghton, John, McCague, Raymond, Rowlands, Martin G

“…In a search for inhibitors of 17 alpha-hydroxylase-C17,20-lyase and testosterone-5 alpha-reductase, target enzymes in the development of drugs to treat…”
Get full text

Crystal Structures of Two Palladacycles from the C–H Activation of 2-(Thiophen-2-yl)pyridine by Callear, Samantha K., Spencer, John, Patel, Hiren, Deadman, John J., Hursthouse, Michael B.

“…A C,N-bound palladacycle dimer has been synthesised by reaction of 2-(thiophen-2-yl)pyridine, LH, with palladium acetate in acetic acid. Characterisation by…”
Get full text