Lista de obras -

1-(2,6-Dibenzyloxybenzoyl)-3-(9H-fluoren-9-yl)-urea: a novel cyclophilin A allosteric activator.

artículo científico publicado en 2012

2-Arylbenzo[b]furan derivatives as potent human lipoxygenase inhibitors.

artículo científico publicado en 2016

2-amido-3-(1H-indol-3-yl)-N-substituted-propanamides as a new class of falcipain-2 inhibitors. 1. Design, synthesis, biological evaluation and binding model studies.

artículo científico publicado en 2009

A genome-wide positioning systems network algorithm for in silico drug repurposing

scientific article published on 02 August 2019

A highly selective space-folded photo-induced electron transfer fluorescent probe for carbonic anhydrase isozymes IX and its applications for biological imaging

artículo científico publicado en 2011

A novel imidazolate-bridged heterodinuclear Cu(II)Zn(II) complex derived from a unique macrocyclic ligand with two hydroxyethyl pendants.

artículo científico publicado en 2003

Antiproliferative activity and therapeutic implications of potassium tris(4-methyl-1-pyrazolyl) borohydride in hepatocellular carcinoma.

artículo científico publicado en 2014

Assembly of a Highly Stable Luminescent Zn5 Cluster and Application to Bio-Imaging.

artículo científico publicado en 2016

Binding of oxo-Cu2 clusters to ferric ion-binding protein A from Neisseria gonorrhoeae: a structural insight.

artículo científico publicado en 2013

Bioactive phenolics and terpenoids from Manglietia insignis.

artículo científico publicado en 2012

CH(II), a cerebroprotein hydrolysate, exhibits potential neuro-protective effect on Alzheimer's disease

artículo científico publicado en 2019

Caffeic acid phenethyl ester (CAPE), an active component of propolis, inhibits Helicobacter pylori peptide deformylase activity.

artículo científico publicado en 2013

Coexistence of long-range ferromagnetic ordering and glassy behavior in one-dimensional bimetallic cyano-bridged polymers.

artículo científico publicado en 2003

Coptisine, a natural alkaloid from Coptidis Rhizoma, inhibit Plasmodium Falciparum Dihydroorotate Dehydrogenase

artículo científico publicado en 2018

Deoxyelephantopin inhibits cancer cell proliferation and functions as a selective partial agonist against PPARgamma.

artículo científico publicado en 2007

Design, synthesis and biological evaluation of 3-piperazinecarboxylate sarsasapogenin derivatives as potential multifunctional anti-Alzheimer agents

artículo científico publicado en 2018

Design, synthesis and inhibitory activity against human dihydroorotate dehydrogenase (hDHODH) of 1,3-benzoazole derivatives bearing amide units

artículo científico publicado en 2016

Design, synthesis, X-ray crystallographic analysis, and biological evaluation of thiazole derivatives as potent and selective inhibitors of human dihydroorotate dehydrogenase

artículo científico publicado en 2015

Development of a new colorimetric assay for lipoxygenase activity.

artículo científico publicado en 2013

Discovery of Novel Small Molecule Anti-HCV Agents via the CypA Inhibitory Mechanism Using O-Acylation-Directed Lead Optimization.

artículo científico publicado en 2015

Discovery of diverse human dihydroorotate dehydrogenase inhibitors as immunosuppressive agents by structure-based virtual screening

artículo científico publicado en 2012

Discovery of inhibitors to block interactions of HIV-1 integrase with human LEDGF/p75 via structure-based virtual screening and bioassays.

artículo científico publicado en 2012

Discovery of natural estrogen receptor modulators with structure-based virtual screening.

artículo científico publicado en 2013

Discovery of new potent inhibitors for carbonic anhydrase IX by structure-based virtual screening

scientific article published on 29 April 2013

Discovery of non-peptide inhibitors of Plasmepsin II by structure-based virtual screening.

artículo científico publicado en 2013

Discovery of potent ligands for estrogen receptor beta by structure-based virtual screening.

artículo científico publicado en 2010

Drug Repurposing of Histone Deacetylase Inhibitors That Alleviate Neutrophilic Inflammation in Acute Lung Injury and Idiopathic Pulmonary Fibrosis via Inhibiting Leukotriene A4 Hydrolase and Blocking LTB4 Biosynthesis.

artículo científico publicado en 2017

HL005--a new selective PPARγ antagonist specifically inhibits the proliferation of MCF-7.

artículo científico publicado en 2011

Identification of Essential Sensitive Regions of the Aerolysin Nanopore for Single Oligonucleotide Analysis

artículo científico publicado en 2018

Identification of diverse dipeptidyl peptidase IV inhibitors via structure-based virtual screening

artículo científico publicado en 2012

Identification of diverse natural products as falcipain-2 inhibitors through structure-based virtual screening

artículo científico publicado en 2014

Identification of inhibitors against p90 ribosomal S6 kinase 2 (RSK2) through structure-based virtual screening with the inhibitor-constrained refined homology model.

artículo científico publicado en 2011

Identification of novel falcipain-2 inhibitors as potential antimalarial agents through structure-based virtual screening.

artículo científico publicado en 2009

Identification of old drugs as potential inhibitors of HIV-1 integrase – human LEDGF/p75 interaction via molecular docking ⬇️

artículo científico publicado el 26 de junio de 2012

Identification, synthesis and pharmacological evaluation of novel anti-EV71 agents via cyclophilin A inhibition

artículo científico publicado en 2015

In silico prediction of chemical mechanism of action via an improved network-based inference method

artículo científico publicado en 2016

Kinetic analysis of carboxy ester hydrolysis by a dinuclear Zn(II) complex.

artículo científico publicado en 2004

Lanostane Triterpenoids from the Stems of Schisandra glaucescens ⬇️

artículo científico publicado el 26 de enero de 2012

Luciferase reporter gene assay on human 5-HT receptor: which response element should be chosen?

artículo científico publicado en 2015

MAD2-p31comet axis deficiency reduces cell proliferation, migration and sensitivity of microtubule-interfering agents in glioma.

artículo científico publicado en 2018

Metabolomic investigation of regional brain tissue dysfunctions induced by global cerebral ischemia

artículo científico publicado en 2016

Moracin C, A Phenolic Compound Isolated from Artocarpus heterophyllus, Suppresses Lipopolysaccharide-Activated Inflammatory Responses in Murine Raw264.7 Macrophages ⬇️

artículo científico publicado en 2016

Myricetin is a novel inhibitor of human inosine 5'-monophosphate dehydrogenase with anti-leukemia activity.

artículo científico publicado en 2016

Natural products as a gold mine for selective matrix metalloproteinases inhibitors.

artículo científico publicado en 2012

New tricks for human farnesyltransferase inhibitor: cancer and beyond

scientific article published on 16 February 2017

Novel benzoyl thioureido benzene sulfonamides as highly potent and selective inhibitors of carbonic anhydrase IX: optimization and bioactive studies

scientific article published on 09 November 2018

Optimization of heterocyclic substituted benzenesulfonamides as novel carbonic anhydrase IX inhibitors and their structure activity relationship.

artículo científico publicado en 2013

Pyrido[1,2-a]pyrimidin-4-ones as antiplasmodial falcipain-2 inhibitors.

artículo científico publicado en 2012

Quantitative and systems pharmacology 2. In silico polypharmacology of G protein-coupled receptor ligands via network-based approaches.

artículo científico publicado en 2017

Rationally Designed Sensing Selectivity and Sensitivity of an Aerolysin Nanopore via Site-Directed Mutagenesis

artículo científico publicado en 2018

SHAFTS: a hybrid approach for 3D molecular similarity calculation. 2. Prospective case study in the discovery of diverse p90 ribosomal S6 protein kinase 2 inhibitors to suppress cell migration.

artículo científico publicado en 2011

Selective ligands of estrogen receptor β discovered using pharmacophore mapping and structure-based virtual screening.

artículo científico publicado en 2014

Selective targeting p53WT lung cancer cells harboring homozygous p53 Arg72 by an inhibitor of CypA.

artículo científico publicado en 2017

Structural Insight into the Mechanisms of Wnt Signaling Antagonism by Dkk

artículo científico publicado en 2008

Substituted indolin-2-ones as p90 ribosomal S6 protein kinase 2 (RSK2) inhibitors: Molecular docking simulation and structure-activity relationship analysis.

artículo científico publicado en 2013

Syntheses, structures, and properties of imidazolate-bridged Cu(II)-Cu(II) and Cu(II)-Zn(II) dinuclear complexes of a single macrocyclic ligand with two hydroxyethyl pendants.

artículo científico publicado en 2003

Synthesis and antimalarial activity of novel dihydro-artemisinin derivatives.

artículo científico publicado en 2011

Synthesis of derivatives of methyl rosmarinate and their inhibitory activities against matrix metalloproteinase-1 (MMP-1).

artículo científico publicado en 2012

Synthesis, activity evaluation, and docking analysis of barbituric acid aryl hydrazone derivatives as RSK2 inhibitors.

artículo científico publicado en 2012

Synthesis, estrogenic activity, and anti-osteoporosis effects in ovariectomized rats of resveratrol oligomer derivatives

artículo científico publicado en 2015

Synthesis, structure-activity relationship, and pharmacophore modeling studies of pyrazole-3-carbohydrazone derivatives as dipeptidyl peptidase IV inhibitors.

artículo científico publicado en 2012

Target identification among known drugs by deep learning from heterogeneous networks

artículo científico publicado en 2020

The efficient expression of human fibroblast collagenase in Escherichia coli and the discovery of flavonoid inhibitors.

artículo científico publicado en 2012

Lista de obras de

1-(2,6-Dibenzyloxybenzoyl)-3-(9H-fluoren-9-yl)-urea: a novel cyclophilin A allosteric activator.

2-Arylbenzo[b]furan derivatives as potent human lipoxygenase inhibitors.

2-amido-3-(1H-indol-3-yl)-N-substituted-propanamides as a new class of falcipain-2 inhibitors. 1. Design, synthesis, biological evaluation and binding model studies.

A genome-wide positioning systems network algorithm for in silico drug repurposing

A highly selective space-folded photo-induced electron transfer fluorescent probe for carbonic anhydrase isozymes IX and its applications for biological imaging

A novel imidazolate-bridged heterodinuclear Cu(II)Zn(II) complex derived from a unique macrocyclic ligand with two hydroxyethyl pendants.

Antiproliferative activity and therapeutic implications of potassium tris(4-methyl-1-pyrazolyl) borohydride in hepatocellular carcinoma.

Assembly of a Highly Stable Luminescent Zn5 Cluster and Application to Bio-Imaging.

Binding of oxo-Cu2 clusters to ferric ion-binding protein A from Neisseria gonorrhoeae: a structural insight.

Bioactive phenolics and terpenoids from Manglietia insignis.

CH(II), a cerebroprotein hydrolysate, exhibits potential neuro-protective effect on Alzheimer's disease

Caffeic acid phenethyl ester (CAPE), an active component of propolis, inhibits Helicobacter pylori peptide deformylase activity.

Coexistence of long-range ferromagnetic ordering and glassy behavior in one-dimensional bimetallic cyano-bridged polymers.

Coptisine, a natural alkaloid from Coptidis Rhizoma, inhibit Plasmodium Falciparum Dihydroorotate Dehydrogenase

Deoxyelephantopin inhibits cancer cell proliferation and functions as a selective partial agonist against PPARgamma.

Design, synthesis and biological evaluation of 3-piperazinecarboxylate sarsasapogenin derivatives as potential multifunctional anti-Alzheimer agents

Design, synthesis and inhibitory activity against human dihydroorotate dehydrogenase (hDHODH) of 1,3-benzoazole derivatives bearing amide units

Design, synthesis, X-ray crystallographic analysis, and biological evaluation of thiazole derivatives as potent and selective inhibitors of human dihydroorotate dehydrogenase

Development of a new colorimetric assay for lipoxygenase activity.

Discovery of Novel Small Molecule Anti-HCV Agents via the CypA Inhibitory Mechanism Using O-Acylation-Directed Lead Optimization.

Discovery of diverse human dihydroorotate dehydrogenase inhibitors as immunosuppressive agents by structure-based virtual screening

Discovery of inhibitors to block interactions of HIV-1 integrase with human LEDGF/p75 via structure-based virtual screening and bioassays.

Discovery of natural estrogen receptor modulators with structure-based virtual screening.

Discovery of new potent inhibitors for carbonic anhydrase IX by structure-based virtual screening

Discovery of non-peptide inhibitors of Plasmepsin II by structure-based virtual screening.

Discovery of potent ligands for estrogen receptor beta by structure-based virtual screening.

Drug Repurposing of Histone Deacetylase Inhibitors That Alleviate Neutrophilic Inflammation in Acute Lung Injury and Idiopathic Pulmonary Fibrosis via Inhibiting Leukotriene A4 Hydrolase and Blocking LTB4 Biosynthesis.

HL005--a new selective PPARγ antagonist specifically inhibits the proliferation of MCF-7.

Identification of Essential Sensitive Regions of the Aerolysin Nanopore for Single Oligonucleotide Analysis

Identification of diverse dipeptidyl peptidase IV inhibitors via structure-based virtual screening

Identification of diverse natural products as falcipain-2 inhibitors through structure-based virtual screening

Identification of inhibitors against p90 ribosomal S6 kinase 2 (RSK2) through structure-based virtual screening with the inhibitor-constrained refined homology model.

Identification of novel falcipain-2 inhibitors as potential antimalarial agents through structure-based virtual screening.

Identification of old drugs as potential inhibitors of HIV-1 integrase – human LEDGF/p75 interaction via molecular docking ⬇️

Identification, synthesis and pharmacological evaluation of novel anti-EV71 agents via cyclophilin A inhibition

In silico prediction of chemical mechanism of action via an improved network-based inference method

Kinetic analysis of carboxy ester hydrolysis by a dinuclear Zn(II) complex.

Lanostane Triterpenoids from the Stems of Schisandra glaucescens ⬇️

Luciferase reporter gene assay on human 5-HT receptor: which response element should be chosen?

MAD2-p31comet axis deficiency reduces cell proliferation, migration and sensitivity of microtubule-interfering agents in glioma.

Metabolomic investigation of regional brain tissue dysfunctions induced by global cerebral ischemia

Moracin C, A Phenolic Compound Isolated from Artocarpus heterophyllus, Suppresses Lipopolysaccharide-Activated Inflammatory Responses in Murine Raw264.7 Macrophages ⬇️

Myricetin is a novel inhibitor of human inosine 5'-monophosphate dehydrogenase with anti-leukemia activity.

Natural products as a gold mine for selective matrix metalloproteinases inhibitors.

New tricks for human farnesyltransferase inhibitor: cancer and beyond

Novel benzoyl thioureido benzene sulfonamides as highly potent and selective inhibitors of carbonic anhydrase IX: optimization and bioactive studies

Optimization of heterocyclic substituted benzenesulfonamides as novel carbonic anhydrase IX inhibitors and their structure activity relationship.

Pyrido[1,2-a]pyrimidin-4-ones as antiplasmodial falcipain-2 inhibitors.

Quantitative and systems pharmacology 2. In silico polypharmacology of G protein-coupled receptor ligands via network-based approaches.

Rationally Designed Sensing Selectivity and Sensitivity of an Aerolysin Nanopore via Site-Directed Mutagenesis

SHAFTS: a hybrid approach for 3D molecular similarity calculation. 2. Prospective case study in the discovery of diverse p90 ribosomal S6 protein kinase 2 inhibitors to suppress cell migration.

Selective ligands of estrogen receptor β discovered using pharmacophore mapping and structure-based virtual screening.

Selective targeting p53WT lung cancer cells harboring homozygous p53 Arg72 by an inhibitor of CypA.

Structural Insight into the Mechanisms of Wnt Signaling Antagonism by Dkk

Substituted indolin-2-ones as p90 ribosomal S6 protein kinase 2 (RSK2) inhibitors: Molecular docking simulation and structure-activity relationship analysis.

Syntheses, structures, and properties of imidazolate-bridged Cu(II)-Cu(II) and Cu(II)-Zn(II) dinuclear complexes of a single macrocyclic ligand with two hydroxyethyl pendants.

Synthesis and antimalarial activity of novel dihydro-artemisinin derivatives.

Synthesis of derivatives of methyl rosmarinate and their inhibitory activities against matrix metalloproteinase-1 (MMP-1).

Synthesis, activity evaluation, and docking analysis of barbituric acid aryl hydrazone derivatives as RSK2 inhibitors.

Synthesis, estrogenic activity, and anti-osteoporosis effects in ovariectomized rats of resveratrol oligomer derivatives

Synthesis, structure-activity relationship, and pharmacophore modeling studies of pyrazole-3-carbohydrazone derivatives as dipeptidyl peptidase IV inhibitors.

Target identification among known drugs by deep learning from heterogeneous networks

The efficient expression of human fibroblast collagenase in Escherichia coli and the discovery of flavonoid inhibitors.