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New Proluciferin Substrates for Human CYP4 Family Enzymes

Applied biochemistry and biotechnology, 2021-01, Vol.193 (1), p.218-237

2021

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Identification of New Substrates and Inhibitors of Human CYP2A7

Molecules (Basel, Switzerland), 2024-05, Vol.29 (10), p.2191

2024

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HuskinDB, a database for skin permeation of xenobiotics

Scientific data, 2020-12, Vol.7 (1), p.426, Article 426

2020

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Complete Reaction Phenotyping of Propranolol and 4-Hydroxypropranolol with the 19 Enzymes of the Human UGT1 and UGT2 Families

International journal of molecular sciences, 2022-07, Vol.23 (13), p.7476

2022

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Author Correction: Targeted small molecule inhibitors blocking the cytolytic effects of pneumolysin and homologous toxins

Nature communications, 2024-05, Vol.15 (1), p.4323-4323, Article 4323

2024

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Development of an HPLC-MS/MS Method for Chiral Separation and Quantitation of (R)- and (S)-Salbutamol and Their Sulfoconjugated Metabolites in Urine to Investigate Stereoselective Sulfonation

Molecules (Basel, Switzerland), 2023-10, Vol.28 (20), p.7206

2023

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Identification of bioactive natural products by pharmacophore-based virtual screening

Current pharmaceutical design, 2010-05, Vol.16 (15), p.1666-1681

2010

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Biased Ligands Differentially Shape the Conformation of the Extracellular Loop Region in 5-HT2B Receptors

International journal of molecular sciences, 2020-12, Vol.21 (24), p.9728

2020

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Targeted small molecule inhibitors blocking the cytolytic effects of pneumolysin and homologous toxins

Nature communications, 2024-04, Vol.15 (1), p.3537-3537, Article 3537

2024

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NSC23766, a widely used inhibitor of Rac1 activation, additionally acts as a competitive antagonist at muscarinic acetylcholine receptors

The Journal of pharmacology and experimental therapeutics, 2013-10, Vol.347 (1), p.69-79

2013

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How To Optimize Shape-Based Virtual Screening: Choosing the Right Query and Including Chemical Information

Journal of Chemical Information and Modeling, 2009-03, Vol.49 (3), p.678-692

2009

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N‐methyl‐D‐aspartate receptor dysfunction by unmutated human antibodies against the NR1 subunit

Annals of neurology, 2019-05, Vol.85 (5), p.771-776

2019

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Disrupting TSLP–TSLP receptor interactions via putative small molecule inhibitors yields a novel and efficient treatment option for atopic diseases

EMBO molecular medicine, 2024-07, Vol.16 (7), p.1630-1656

2024

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Selective Inhibitors of the Protein Tyrosine Phosphatase SHP2 Block Cellular Motility and Growth of Cancer Cells in vitro and in vivo

ChemMedChem, 2015-05, Vol.10 (5), p.815-826

2015

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Identification and validation of a novel dual small-molecule TLR2/8 antagonist

Biochemical pharmacology, 2020-07, Vol.177, p.113957, Article 113957

2020

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Comparison of the three SARMs RAD-140, GLPG0492 and GSK-2881078 in two different in vitro bioassays, and in an in silico androgen receptor binding assay

The Journal of steroid biochemistry and molecular biology, 2019-05, Vol.189, p.81-86

2019

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Strategies for 3D pharmacophore-based virtual screening

Drug discovery today. Technologies, 2010, Vol.7 (4), p.e221-e228

2010

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Crystal structures of glycoprotein D of equine alphaherpesviruses reveal potential binding sites to the entry receptor MHC-I

Frontiers in microbiology, 2023-05, Vol.14, p.1197120-1197120

2023

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Functional Expression of All Human Sulfotransferases in Fission Yeast, Assay Development, and Structural Models for Isoforms SULT4A1 and SULT6B1

Biomolecules (Basel, Switzerland), 2020-11, Vol.10 (11), p.1517

2020

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Inhibitor Design Strategy Based on an Enzyme Structural Flexibility: A Case of Bacterial MurD Ligase

Journal of chemical information and modeling, 2014-05, Vol.54 (5), p.1451-1466

2014

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Corticosteroid Biosynthesis Revisited: No Direct Hydroxylation of Pregnenolone by Steroid 21-Hydroxylase

Frontiers in endocrinology (Lausanne), 2021-06, Vol.12, p.633785-633785

2021

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Computational tools for in silico fragment-based drug design

Current topics in medicinal chemistry, 2012-09, Vol.12 (17), p.1935-1943

2012

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Validated Capillary Zone Electrophoresis Method for Impurity Profiling and Determination of NiII(3-OMe-Salophene)

Separations, 2022-01, Vol.9 (2), p.25

2022

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Fast and Efficient in Silico 3D Screening: Toward Maximum Computational Efficiency of Pharmacophore-Based and Shape-Based Approaches

Journal of chemical information and modeling, 2007-11, Vol.47 (6), p.2182-2196

2007

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The Protein Data Bank (PDB), Its Related Services and Software Tools as Key Components for In Silico Guided Drug Discovery

Journal of medicinal chemistry, 2008-11, Vol.51 (22), p.7021-7040

2008

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New Proluciferin Substrates for Human CYP4 Family Enzymes

Identification of New Substrates and Inhibitors of Human CYP2A7

HuskinDB, a database for skin permeation of xenobiotics

Complete Reaction Phenotyping of Propranolol and 4-Hydroxypropranolol with the 19 Enzymes of the Human UGT1 and UGT2 Families

Author Correction: Targeted small molecule inhibitors blocking the cytolytic effects of pneumolysin and homologous toxins

Development of an HPLC-MS/MS Method for Chiral Separation and Quantitation of (R)- and (S)-Salbutamol and Their Sulfoconjugated Metabolites in Urine to Investigate Stereoselective Sulfonation

Identification of bioactive natural products by pharmacophore-based virtual screening

Biased Ligands Differentially Shape the Conformation of the Extracellular Loop Region in 5-HT2B Receptors

Targeted small molecule inhibitors blocking the cytolytic effects of pneumolysin and homologous toxins

NSC23766, a widely used inhibitor of Rac1 activation, additionally acts as a competitive antagonist at muscarinic acetylcholine receptors

How To Optimize Shape-Based Virtual Screening: Choosing the Right Query and Including Chemical Information

N‐methyl‐D‐aspartate receptor dysfunction by unmutated human antibodies against the NR1 subunit

Disrupting TSLP–TSLP receptor interactions via putative small molecule inhibitors yields a novel and efficient treatment option for atopic diseases

Selective Inhibitors of the Protein Tyrosine Phosphatase SHP2 Block Cellular Motility and Growth of Cancer Cells in vitro and in vivo

Identification and validation of a novel dual small-molecule TLR2/8 antagonist

Comparison of the three SARMs RAD-140, GLPG0492 and GSK-2881078 in two different in vitro bioassays, and in an in silico androgen receptor binding assay

Strategies for 3D pharmacophore-based virtual screening

Crystal structures of glycoprotein D of equine alphaherpesviruses reveal potential binding sites to the entry receptor MHC-I

Functional Expression of All Human Sulfotransferases in Fission Yeast, Assay Development, and Structural Models for Isoforms SULT4A1 and SULT6B1

Inhibitor Design Strategy Based on an Enzyme Structural Flexibility: A Case of Bacterial MurD Ligase

Corticosteroid Biosynthesis Revisited: No Direct Hydroxylation of Pregnenolone by Steroid 21-Hydroxylase

Computational tools for in silico fragment-based drug design

Validated Capillary Zone Electrophoresis Method for Impurity Profiling and Determination of NiII(3-OMe-Salophene)

Fast and Efficient in Silico 3D Screening: Toward Maximum Computational Efficiency of Pharmacophore-Based and Shape-Based Approaches

The Protein Data Bank (PDB), Its Related Services and Software Tools as Key Components for In Silico Guided Drug Discovery

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