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List of works by Jana Sopková-de Oliveira Santos

11th German Conference on Chemoinformatics (GCC 2015) : Fulda, Germany. 8-10 November 2015.

scientific article (publication date: April 2016)

3D-QSAR and docking studies of selective GSK-3beta inhibitors. Comparison with a thieno[2,3-b]pyrrolizinone derivative, a new potential lead for GSK-3beta ligands.

scientific article published in May 2005

A Three-Site Mechanism for Agonist/Antagonist Selective Binding to Vasopressin Receptors

scientific article published on 17 May 2016

A straightforward asymmetric synthesis of 1,2-disubstituted ferrocenylalkyl amines with the unusual (S(Fc),S) configuration

scientific article published on 01 December 2007

Assembly of benzene-1,3,5-tris(methylenephosphonic acid) and guanidinium salt: Single crystal-X-ray characterisation and31P solid state NMR investigations

Benzylphenylpyrrolizinones with Anti-amyloid and Radical Scavenging Effects, Potentially Useful in Alzheimer's Disease Treatment.

scientific article published on 25 March 2017

Binding mode of Pyridoclax to myeloid cell leukemia-1 (Mcl-1) revealed by nuclear magnetic resonance spectroscopy, docking and molecular dynamics approaches

scientific article published on 29 October 2019

Conformation and Dynamics of Human Urotensin II and Urotensin Related Peptide in Aqueous Solution.

scientific article published on 5 January 2017

Conformation control of abiotic α-helical foldamers

scientific article

Definition of new pharmacophores for nonpeptide antagonists of human urotensin-II. Comparison with the 3D-structure of human urotensin-II and URP

scientific article published on 01 March 2007

Design, Synthesis, Molecular Dynamics Simulation and Functional Evaluation of a Novel Series of 26RFa Peptide Analogues Containing a Mono- or Polyalkyl Guanidino Arginine Derivative

scientific article published on 07 November 2018

Design, synthesis, and pharmacological evaluation of multitarget-directed ligands with both serotonergic subtype 4 receptor (5-HT4R) partial agonist and 5-HT6R antagonist activities, as potential treatment of Alzheimer's disease

scientific article published on 26 May 2016

Diastereoselective addition of enantiopure lithium tert-butylsulfinylferrocene to imines

scientific article published on 01 December 2006

Effect of oral exposure to the acaricide pirimicarb, a new varroacide candidate, on apis mellifera feeding rate

scientific article published on 31 January 2018

First Synthesis of Racemic <i>Trans</i> Propargylamino-Donepezil, a Pleiotrope Agent Able to Both Inhibit AChE and MAO-B, with Potential Interest against Alzheimer's Disease

scientific article published on 27 December 2020

First evidence that oligopyridines, α-helix foldamers, inhibit Mcl-1 and sensitize ovarian carcinoma cells to Bcl-xL-targeting strategies

scientific article published on 04 February 2015

Fluoride ion and phosphines as nucleophilic catalysts: synthesis of 1,4-benzothiazepines from cyclic sulfenamides.

scientific article

Hot-Spots of Mcl-1 Protein

scientific article published on 16 October 2019

Hydrogenative desulphurization of thienopyrrolizinones: an easy and selective access to (Z)-phenethylidenepyrrolizinones with in vitro cytotoxic activity.

scientific article

In silico chemical library screening and experimental validation of novel compounds with potential varroacide activities

scientific article published on 22 May 2019

Inhibiting Acetylcholinesterase to Activate Pleiotropic Prodrugs with Therapeutic Interest in Alzheimer's Disease

scientific article published on 31 July 2019

Interpretation of honeybees contact toxicity associated to acetylcholinesterase inhibitors

scientific article published on 8 February 2012

New hypotheses for the binding mode of 4- and 7-substituted indazoles in the active site of neuronal nitric oxide synthase ⬇️

scientific article published on 03 July 2012

Novel benzylidenephenylpyrrolizinones with pleiotropic activities potentially useful in Alzheimer's disease treatment.

scientific article

Novel multitarget-directed ligands (MTDLs) with acetylcholinesterase (AChE) inhibitory and serotonergic subtype 4 receptor (5-HT4R) agonist activities as potential agents against Alzheimer's disease: the design of donecopride

scientific article published on 31 March 2015

Oxygen Pressurized X-Ray Crystallography: Probing the Dioxygen Binding Site in Cofactorless Urate Oxidase and Implications for Its Catalytic Mechanism

scientific article

Pressure-response analysis of anesthetic gases xenon and nitrous oxide on urate oxidase: a crystallographic study

scientific article

Protective effects of caffeic acid against hypothalamic neuropeptides alterations induced by malathion in rat.

scientific article published on 18 November 2014

Protein crystallography under xenon and nitrous oxide pressure: comparison with in vivo pharmacology studies and implications for the mechanism of inhaled anesthetic action.

scientific article published on 6 October 2006

Rational design of novel benzisoxazole derivatives with acetylcholinesterase inhibitory and serotoninergic 5-HT4 receptors activities for the treatment of Alzheimer's disease

scientific article published on 20 February 2020

Receptor- and ligand-based study on novel 2,2'-bithienyl derivatives as non-peptidic AANAT inhibitors

scientific article

Room-temperature ortho-alkoxylation and -halogenation of N-tosylbenzamides by using palladium(II)-catalyzed C-H activation

scientific article published on 14 May 2014

Straightforward stereoselective synthesis of spiro-epoxyoxindoles

scientific article published on 30 March 2007

Structural Characterizations of Oligopyridyl Foldamers, α-Helix Mimetics

scientific article published on 17 January 2012

Synthesis and biological evaluation as AChE inhibitors of new indanones and thiaindanones related to donepezil.

scientific article published on 30 August 2005

Synthesis and biological evaluation of new 5-benzylated 4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indoles as PI3Kα inhibitors

scientific article

Synthesis and biological evaluation of thienopyrrolizines, a new family of CDK/GSK-3 inhibitors.

scientific article published in December 2004

Synthesis of 3-amino-thiochromanes from 4-benzyl 2-thiazolines, via an unprecedented intramolecular electrophilic aromatic substitution

scientific article published on 22 April 2010

Synthesis of Pyridoclax Analogues: Insight into Their Druggability by Investigating Their Physicochemical Properties and Interactions with Membranes

scientific article published on 26 November 2019

Synthesis of new dipyrrolo- and furopyrrolopyrazinones related to tripentones and their biological evaluation as potential kinases (CDKs1-5, GSK-3) inhibitors

scientific article published on 23 May 2008

Synthesis of novel 7-oxo and 7-hydroxy trifluoroallocolchicinoids with cytotoxic effect

scientific article published on 03 March 2012

Synthesis, pharmacological study and modeling of 7-methoxyindazole and related substituted indazoles as neuronal nitric oxide synthase inhibitors

scientific article published in April 2003

Tau protein aggregation: Key features to improve drug discovery screening

scientific article published in 2022

Three-dimensional model of the human urotensin-II receptor: docking of human urotensin-II and nonpeptide antagonists in the binding site and comparison with an antagonist pharmacophore model

scientific article published in October 2008

Toward Understanding Mcl-1 Promiscuous and Specific Binding Mode.

scientific article

Toward safer thrombolytic agents in stroke: molecular requirements for NMDA receptor-mediated neurotoxicity.

scientific article

Virtual screening discovery of new acetylcholinesterase inhibitors issued from CERMN chemical library

scientific article

X-ray structure of floridoside isolated from the marine red algae Dilsea carnosa.

scientific article published in July 2008

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