List of works - Salvatore Guccione

3D-QSAR using 'multiconformer' alignment: the use of HASL in the analysis of 5-HT1A thienopyrimidinone ligands

scientific article published on 01 October 2000

4-Methyl-2-[N-(3,4-methylenedioxybenzylidene)hydrazino]thiazole and its reduction product, 4-methyl-2-[N-(3,4-methylenedioxybenzylidene)hydrazono]-4,5-dihydrothiazole.

scientific article published on 16 January 2002

Building a model of interaction at the NK-2 receptors: Polycondensed heterocycles containing the pyrimidoindole skeleton

Combined NMR-crystallographic and modelling investigation of the inclusion of molsidomine into alpha-, beta- and gamma-cyclodextrins.

scientific article published on 16 September 2005

Combining NMR and molecular modelling in a drug delivery context: investigation of the multi-mode inclusion of a new NPY-5 antagonist bromobenzenesulfonamide into beta-cyclodextrin

scientific article

Combining molecular modeling with experimental methodologies: mechanism of membrane permeation and accumulation of ofloxacin

scientific article published in December 2002

Computational Comparison of Imidazoline Association with the I2 Binding Site in Human Monoamine Oxidases

Correction to Computational Comparison of Imidazoline Association with the I2 Binding Site in Human Monoamine Oxidases

scholarly article published in Journal of Chemical Information and Modeling

Design, synthesis and binding properties of novel and selective 5-HT(3) and 5-HT(4) receptor ligands

scientific article published in December 2000

Design, synthesis and binding properties of novel and selective 5-HT3 and 5-HT4 receptor ligands

scientific article

Emerging antifungal azoles and effects on Magnaporthe grisea.

scientific article

Enhancement of drug affinity for cell membranes by conjugation with lipoamino acids. I. Synthesis and biological evaluation of lipophilic conjugates of tranylcypromine

scientific article published on 29 August 2005

Evaluation of imidazole-based compounds as heme oxygenase-1 inhibitors

scientific article published on 9 October 2012

Heme oxygenase-2/adiponectin protein-protein interaction in metabolic syndrome.

scientific article published on 21 February 2013

How does binding of imidazole-based inhibitors to heme oxygenase-1 influence their conformation? Insights combining crystal structures and molecular modelling.

scientific article published on 14 July 2015

How to Choose the Suitable Template for Homology Modelling of GPCRs: 5-HT7 Receptor as a Test Case.

scientific article published on 28 June 2016

Hydrophobic molecular similarity from MST fractional contributions to the octanol/water partition coefficient.

scientific article published in June 2005

Identification of 5-Methoxyflavone as a Novel DNA Polymerase-Beta Inhibitor and Neuroprotective Agent against Beta-Amyloid Toxicity.

scientific article published on 30 October 2015

Identification of essential residues for binding and activation in the human 5-HT7(a) serotonin receptor by molecular modeling and site-directed mutagenesis

scientific article published on 8 May 2015

Interactions of imidazoline ligands with the active site of purified monoamine oxidase A

scientific article published on 01 March 2007

Lipophilic conjugates of methotrexate with short-chain alkylamino acids as DHFR inhibitors. Synthesis, biological evaluation, and molecular modeling.

scientific article published on June 2004

Molecular properties of ibuprofen and its solid dispersions with Eudragit RL100 studied by solid-state nuclear magnetic resonance

scientific article published on 24 August 2005

Multiconformational Method for Analyzing the Biological Activity of Molecular Structures

Neuroprotective effects of the monoamine oxidase inhibitor tranylcypromine and its amide derivatives against Aβ(1-42)-induced toxicity.

scientific article

Novel Benzo[b]thiophene Derivatives as New Potential Antidepressants with Rapid Onset of Action

scientific article published on 06 April 2011

Parameters for Irreversible Inactivation of Monoamine Oxidase

scientific article published on 13 December 2020

Pharmacological properties and biochemical mechanisms of μ-opioid receptor ligands might be due to different binding poses: MD Studies

scientific article published on 25 September 2020

Potential immunoregulatory role of heme oxygenase-1 in human milk: a combined biochemical and molecular modeling approach.

scientific article published on 31 October 2009

Potential of aryl–urea–benzofuranylthiazoles hybrids as multitasking agents in Alzheimer's disease

scientific article published on 10 July 2015

Preparation, characterisation and photosensitivity studies of solid dispersions of diflunisal and Eudragit RS100 and RL100.

scientific article

Sequential application of ligand and structure based modeling approaches to index chemicals for their hH4R antagonism

scientific article

Spectroscopic Investigation and Molecular Modeling on Porphyrin/PAMAM Supramolecular Adduct

Substrate and inhibitor specificity of class 1 and class 2 histone deacetylases

scientific article published on 29 March 2006

Sulfonilamidothiopyrimidone and thiopyrimidone derivatives as selective COX-2 inhibitors: Synthesis, biological evaluation, and docking studies

scientific article published on 10 September 2012

Synthesis and molecular modeling of new 1-aryl-3-[4-arylpiperazin-1-yl]-1-propane derivatives with high affinity at the serotonin transporter and at 5-HT(1A) receptors

scientific article

Synthesis, benzodiazepine receptor binding and molecular modelling of isochromeno[4,3-c]pyrazol-5(1H)-one derivatives.

scientific article published on 28 June 2012

TCP-FA4: a derivative of tranylcypromine showing improved blood-brain permeability.

scientific article published on 11 August 2009

The cell cycle molecules behind neurodegeneration in Alzheimer's disease: perspectives for drug development.

scientific article published on January 2008

Theoretical calculations of the catalytic triad in short-chain alcohol dehydrogenases/reductases

scientific article published on 2 November 2007

List of works by Salvatore Guccione

3D-QSAR using 'multiconformer' alignment: the use of HASL in the analysis of 5-HT1A thienopyrimidinone ligands

4-Methyl-2-[N-(3,4-methylenedioxybenzylidene)hydrazino]thiazole and its reduction product, 4-methyl-2-[N-(3,4-methylenedioxybenzylidene)hydrazono]-4,5-dihydrothiazole.

Building a model of interaction at the NK-2 receptors: Polycondensed heterocycles containing the pyrimidoindole skeleton

Combined NMR-crystallographic and modelling investigation of the inclusion of molsidomine into alpha-, beta- and gamma-cyclodextrins.

Combining NMR and molecular modelling in a drug delivery context: investigation of the multi-mode inclusion of a new NPY-5 antagonist bromobenzenesulfonamide into beta-cyclodextrin

Combining molecular modeling with experimental methodologies: mechanism of membrane permeation and accumulation of ofloxacin

Computational Comparison of Imidazoline Association with the I2 Binding Site in Human Monoamine Oxidases

Correction to Computational Comparison of Imidazoline Association with the I2 Binding Site in Human Monoamine Oxidases

Design, synthesis and binding properties of novel and selective 5-HT(3) and 5-HT(4) receptor ligands

Design, synthesis and binding properties of novel and selective 5-HT3 and 5-HT4 receptor ligands

Emerging antifungal azoles and effects on Magnaporthe grisea.

Enhancement of drug affinity for cell membranes by conjugation with lipoamino acids. I. Synthesis and biological evaluation of lipophilic conjugates of tranylcypromine

Evaluation of imidazole-based compounds as heme oxygenase-1 inhibitors

Heme oxygenase-2/adiponectin protein-protein interaction in metabolic syndrome.

How does binding of imidazole-based inhibitors to heme oxygenase-1 influence their conformation? Insights combining crystal structures and molecular modelling.

How to Choose the Suitable Template for Homology Modelling of GPCRs: 5-HT7 Receptor as a Test Case.

Hydrophobic molecular similarity from MST fractional contributions to the octanol/water partition coefficient.

Identification of 5-Methoxyflavone as a Novel DNA Polymerase-Beta Inhibitor and Neuroprotective Agent against Beta-Amyloid Toxicity.

Identification of essential residues for binding and activation in the human 5-HT7(a) serotonin receptor by molecular modeling and site-directed mutagenesis

Interactions of imidazoline ligands with the active site of purified monoamine oxidase A

Lipophilic conjugates of methotrexate with short-chain alkylamino acids as DHFR inhibitors. Synthesis, biological evaluation, and molecular modeling.

Molecular properties of ibuprofen and its solid dispersions with Eudragit RL100 studied by solid-state nuclear magnetic resonance

Multiconformational Method for Analyzing the Biological Activity of Molecular Structures

Neuroprotective effects of the monoamine oxidase inhibitor tranylcypromine and its amide derivatives against Aβ(1-42)-induced toxicity.

Novel Benzo[b]thiophene Derivatives as New Potential Antidepressants with Rapid Onset of Action

Parameters for Irreversible Inactivation of Monoamine Oxidase

Pharmacological properties and biochemical mechanisms of μ-opioid receptor ligands might be due to different binding poses: MD Studies

Potential immunoregulatory role of heme oxygenase-1 in human milk: a combined biochemical and molecular modeling approach.

Potential of aryl–urea–benzofuranylthiazoles hybrids as multitasking agents in Alzheimer's disease

Preparation, characterisation and photosensitivity studies of solid dispersions of diflunisal and Eudragit RS100 and RL100.

Sequential application of ligand and structure based modeling approaches to index chemicals for their hH4R antagonism

Spectroscopic Investigation and Molecular Modeling on Porphyrin/PAMAM Supramolecular Adduct

Substrate and inhibitor specificity of class 1 and class 2 histone deacetylases

Sulfonilamidothiopyrimidone and thiopyrimidone derivatives as selective COX-2 inhibitors: Synthesis, biological evaluation, and docking studies

Synthesis and molecular modeling of new 1-aryl-3-[4-arylpiperazin-1-yl]-1-propane derivatives with high affinity at the serotonin transporter and at 5-HT(1A) receptors

Synthesis, benzodiazepine receptor binding and molecular modelling of isochromeno[4,3-c]pyrazol-5(1H)-one derivatives.

TCP-FA4: a derivative of tranylcypromine showing improved blood-brain permeability.

The cell cycle molecules behind neurodegeneration in Alzheimer's disease: perspectives for drug development.

Theoretical calculations of the catalytic triad in short-chain alcohol dehydrogenases/reductases

Unforeseen alkylating effect of triethylorthoformate in the synthesis of pyrazolotriazolopyrimidine derivative