List of works - Darren Fayne

'tieredScreen' - Layered Virtual Screening Tool for the Identification of Novel Estrogen Receptor Alpha Modulators.

scientific article

Comprehensive characterization of cytochrome P450 isozyme selectivity across chemical libraries

scientific article

Consensus Computational Ligand-Based Design for the Identification of Novel Modulators of Human Estrogen Receptor Alpha

scientific article

Corrigendum to "Neuroprotective and anti-inflammatory properties of a novel non-thiazolidinedione PPARγ agonist in vitro and in MPTP-treated mice" [Neuroscience 302 (2015) 23-35]

scientific article published on 19 October 2016

De-peptidising protein-protein interactions - big jobs for small molecules

scientific article published on December 2013

Differential interactions of antiretroviral agents with LXR, ER and GR nuclear receptors: potential contributing factors to adverse events

scientific article

Identification of plasmepsin inhibitors as selective anti-malarial agents using ligand based drug design.

scientific article

Integrated virtual screening for the identification of novel and selective peroxisome proliferator-activated receptor (PPAR) scaffolds

scientific article published on 24 May 2012

Lead Optimization of Benzoxepin-Type Selective Estrogen Receptor (ER) Modulators and Downregulators with Subtype-Specific ERα and ERβ Activity

scientific article published on 01 May 2017

Macrophage migration inhibitory factor (MIF) enzymatic activity and lung cancer

scientific article

Molecular topology applied to the discovery of 1-benzyl-2-(3-fluorophenyl)-4-hydroxy-3-(3-phenylpropanoyl)-2H-pyrrole-5-one as a non-ligand-binding-pocket antiandrogen.

scientific article

Novel Selective Estrogen Receptor Ligand Conjugates Incorporating Endoxifen-Combretastatin and Cyclofenil-Combretastatin Hybrid Scaffolds: Synthesis and Biochemical Evaluation.

scientific article published on 31 August 2017

Oncology exploration: charting cancer medicinal chemistry space

scientific article published in February 2006

Permuting input for more effective sampling of 3D conformer space.

scientific article published in March 2006

Rational Ligand-Based Virtual Screening and Structure–Activity Relationship Studies in the Ligand-Binding Domain of the Glucocorticoid Receptor-α ⬇️

scientific article published on June 1, 2009

Rational Targeting of Peroxisome Proliferating Activated Receptor Subtypes ⬇️

scientific article published on January 1, 2011

Retinazone inhibits certain blood-borne human viruses including Ebola virus Zaire.

scientific article

Single point mutations reveal amino acid residues important for Chromobacterium violaceum transaminase activity in the production of unnatural amino acids

scientific article published in Scientific Reports

Structure-activity relationships in non-ligand binding pocket (non-LBP) diarylhydrazide antiandrogens.

scientific article

Synthesis and evaluation of antiproliferative microtubule-destabilising combretastatin A-4 piperazine conjugates

scientific article published on 01 June 2019

Synthesis, Antiproliferative and Pro-Apoptotic Effects of Nitrostyrenes and Related Compounds in Burkitt's Lymphoma.

scientific article published on 2 October 2017

Synthesis, antiproliferative and pro-apoptotic activity of 2-phenylindoles.

scientific article published on 29 June 2016

The antidepressants maprotiline and fluoxetine have potent selective antiproliferative effects against Burkitt lymphoma independently of the norepinephrine and serotonin transporters.

scientific article

The vascular targeting agent combretastatin-A4 and a novel cis-Restricted {beta}-Lactam Analogue, CA-432, induce apoptosis in human chronic myeloid leukemia cells and ex vivo patient samples including those displaying multidrug resistance.

scientific article published on 10 August 2010

β-Lactam analogues of combretastatin A-4 prevent metabolic inactivation by glucuronidation in chemoresistant HT-29 colon cancer cells.

scientific article published on 24 February 2017

“True” Antiandrogens—Selective Non-Ligand-Binding Pocket Disruptors of Androgen Receptor–Coactivator Interactions: Novel Tools for Prostate Cancer ⬇️

scientific article published on February 10, 2012

List of works by Darren Fayne

'tieredScreen' - Layered Virtual Screening Tool for the Identification of Novel Estrogen Receptor Alpha Modulators.

Comprehensive characterization of cytochrome P450 isozyme selectivity across chemical libraries

Consensus Computational Ligand-Based Design for the Identification of Novel Modulators of Human Estrogen Receptor Alpha

Corrigendum to "Neuroprotective and anti-inflammatory properties of a novel non-thiazolidinedione PPARγ agonist in vitro and in MPTP-treated mice" [Neuroscience 302 (2015) 23-35]

De-peptidising protein-protein interactions - big jobs for small molecules

Differential interactions of antiretroviral agents with LXR, ER and GR nuclear receptors: potential contributing factors to adverse events

Identification of plasmepsin inhibitors as selective anti-malarial agents using ligand based drug design.

Integrated virtual screening for the identification of novel and selective peroxisome proliferator-activated receptor (PPAR) scaffolds

Lead Optimization of Benzoxepin-Type Selective Estrogen Receptor (ER) Modulators and Downregulators with Subtype-Specific ERα and ERβ Activity

Macrophage migration inhibitory factor (MIF) enzymatic activity and lung cancer

Molecular topology applied to the discovery of 1-benzyl-2-(3-fluorophenyl)-4-hydroxy-3-(3-phenylpropanoyl)-2H-pyrrole-5-one as a non-ligand-binding-pocket antiandrogen.

Novel Selective Estrogen Receptor Ligand Conjugates Incorporating Endoxifen-Combretastatin and Cyclofenil-Combretastatin Hybrid Scaffolds: Synthesis and Biochemical Evaluation.

Oncology exploration: charting cancer medicinal chemistry space

Permuting input for more effective sampling of 3D conformer space.

Rational Ligand-Based Virtual Screening and Structure–Activity Relationship Studies in the Ligand-Binding Domain of the Glucocorticoid Receptor-α ⬇️

Rational Targeting of Peroxisome Proliferating Activated Receptor Subtypes ⬇️

Retinazone inhibits certain blood-borne human viruses including Ebola virus Zaire.

Single point mutations reveal amino acid residues important for Chromobacterium violaceum transaminase activity in the production of unnatural amino acids

Structure-activity relationships in non-ligand binding pocket (non-LBP) diarylhydrazide antiandrogens.

Synthesis and evaluation of antiproliferative microtubule-destabilising combretastatin A-4 piperazine conjugates

Synthesis, Antiproliferative and Pro-Apoptotic Effects of Nitrostyrenes and Related Compounds in Burkitt's Lymphoma.

Synthesis, antiproliferative and pro-apoptotic activity of 2-phenylindoles.

The antidepressants maprotiline and fluoxetine have potent selective antiproliferative effects against Burkitt lymphoma independently of the norepinephrine and serotonin transporters.

The vascular targeting agent combretastatin-A4 and a novel cis-Restricted {beta}-Lactam Analogue, CA-432, induce apoptosis in human chronic myeloid leukemia cells and ex vivo patient samples including those displaying multidrug resistance.

β-Lactam analogues of combretastatin A-4 prevent metabolic inactivation by glucuronidation in chemoresistant HT-29 colon cancer cells.

“True” Antiandrogens—Selective Non-Ligand-Binding Pocket Disruptors of Androgen Receptor–Coactivator Interactions: Novel Tools for Prostate Cancer ⬇️