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An end-to-end automated platform process for high-throughput engineering of next-generation multi-specific antibody therapeutics

mAbs, 2021-01, Vol.13 (1), p.1955433-1955433

2021

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Structural and Modeling Studies on ecto-5'-nucleotidase Aiding in Inhibitor Design

Mini reviews in medicinal chemistry, 2015-01, Vol.15 (1), p.34

2015

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Best practices for machine learning in antibody discovery and development

Drug discovery today, 2024-07, Vol.29 (7), p.104025, Article 104025

2024

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Comprehensive knowledge base of two- and three-dimensional activity cliffs for medicinal and computational chemistry

F1000 research, 2015-06, Vol.4, p.168

2015

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Identification of New Chromenone Derivatives as Cholinesterase Inhibitors and Molecular Docking Studies

Medicinal chemistry (Shp-sariqah, United Arab Emirates), 2018-01, Vol.14 (8), p.809

2018

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Current compound coverage of the kinome

Journal of medicinal chemistry, 2015-01, Vol.58 (1), p.30-40

2015

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Comprehensive Analysis of Three-Dimensional Activity Cliffs Formed by Kinase Inhibitors with Different Binding Modes and Cliff Mapping of Structural Analogues

Journal of medicinal chemistry, 2015-01, Vol.58 (1), p.252-264

2015

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Active compounds from a diverse library of triazolothiadiazole and triazolothiadiazine scaffolds: Synthesis, crystal structure determination, cytotoxicity, cholinesterase inhibitory activity, and binding mode analysis

Bioorganic & medicinal chemistry, 2014-11, Vol.22 (21), p.6163-6173

2014

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Computational Screening for mAb Colloidal Stability with Coarse-Grained, Molecular-Scale Simulations

The journal of physical chemistry. B, 2024-02, Vol.128 (6), p.1515-1526

2024

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Evaluation of molecular model-based discovery of ecto-5′-nucleotidase inhibitors on the basis of X-ray structures

Bioorganic & medicinal chemistry, 2013-11, Vol.21 (21), p.6616-6622

2013

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Coumarin-thiazole and -oxadiazole derivatives: Synthesis, bioactivity and docking studies for aldose/aldehyde reductase inhibitors

Bioorganic chemistry, 2016-10, Vol.68, p.177-186

2016

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High-Throughput and Format-Agnostic Mispairing Assay for Multispecific Antibodies Using Intact Mass Spectrometry

Analytical chemistry (Washington), 2023-07, Vol.95 (27), p.10265-10278

2023

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Structural Optimization of Azadipeptide Nitriles Strongly Increases Association Rates and Allows the Development of Selective Cathepsin Inhibitors

Journal of medicinal chemistry, 2011-01, Vol.54 (1), p.396-400

2011

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Chalcone Isomerase from Eubacterium ramulus Catalyzes the Ring Contraction of Flavanonols

Journal of bacteriology, 2016-11, Vol.198 (21), p.2965-2974

2016

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Evaluation of molecular model-based discovery of ecto-5’-nucleotidase inhibitors on the basis of X-ray structures

Journal of cheminformatics, 2014-03, Vol.6 (Suppl 1), p.P13-P13, Article P13

2014

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A Coumarin-Labeled Vinyl Sulfone as Tripeptidomimetic Activity-Based Probe for Cysteine Cathepsins

Chembiochem : a European journal of chemical biology, 2014-05, Vol.15 (7), p.955-959

2014

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Current Compound Coverage of the Kinome: Miniperspective

Journal of medicinal chemistry, 2015-01, Vol.58 (1), p.30-40

2015

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Novel structural hybrids of pyrazolobenzothiazines with benzimidazoles as cholinesterase inhibitors

European journal of medicinal chemistry, 2014-05, Vol.78, p.106-117

2014

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Extension of three-dimensional activity cliff information through systematic mapping of active analogs

RSC advances, 2015-01, Vol.5 (54), p.436-4315

2015

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Phosphono Bisbenzguanidines as Irreversible Dipeptidomimetic Inhibitors and Activity-Based Probes of Matriptase-2

Chemistry : a European journal, 2016-06, Vol.22 (25), p.8525-8535

2016

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Identification of sulfonic acids as efficient ecto-5′-nucleotidase inhibitors

European journal of medicinal chemistry, 2013-12, Vol.70, p.685-691

2013

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Limiting the Number of Potential Binding Modes by Introducing Symmetry into Ligands: Structure-Based Design of Inhibitors for Trypsin-Like Serine Proteases

Chemistry : a European journal, 2016-01, Vol.22 (2), p.610-625

2016

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Synthesis, biological evaluation and molecular docking of N-phenyl thiosemicarbazones as urease inhibitors

Bioorganic chemistry, 2015-08, Vol.61, p.51-57

2015

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Identification and analysis of the currently available high-confidence three-dimensional activity cliffs

RSC advances, 2015-01, Vol.5 (54), p.4366-43668

2015

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An end-to-end automated platform process for high-throughput engineering of next-generation multi-specific antibody therapeutics

Structural and Modeling Studies on ecto-5'-nucleotidase Aiding in Inhibitor Design

Best practices for machine learning in antibody discovery and development

Comprehensive knowledge base of two- and three-dimensional activity cliffs for medicinal and computational chemistry

Identification of New Chromenone Derivatives as Cholinesterase Inhibitors and Molecular Docking Studies

Current compound coverage of the kinome

Comprehensive Analysis of Three-Dimensional Activity Cliffs Formed by Kinase Inhibitors with Different Binding Modes and Cliff Mapping of Structural Analogues

Active compounds from a diverse library of triazolothiadiazole and triazolothiadiazine scaffolds: Synthesis, crystal structure determination, cytotoxicity, cholinesterase inhibitory activity, and binding mode analysis

Computational Screening for mAb Colloidal Stability with Coarse-Grained, Molecular-Scale Simulations

Evaluation of molecular model-based discovery of ecto-5′-nucleotidase inhibitors on the basis of X-ray structures

Coumarin-thiazole and -oxadiazole derivatives: Synthesis, bioactivity and docking studies for aldose/aldehyde reductase inhibitors

High-Throughput and Format-Agnostic Mispairing Assay for Multispecific Antibodies Using Intact Mass Spectrometry

Structural Optimization of Azadipeptide Nitriles Strongly Increases Association Rates and Allows the Development of Selective Cathepsin Inhibitors

Chalcone Isomerase from Eubacterium ramulus Catalyzes the Ring Contraction of Flavanonols

Evaluation of molecular model-based discovery of ecto-5’-nucleotidase inhibitors on the basis of X-ray structures

A Coumarin-Labeled Vinyl Sulfone as Tripeptidomimetic Activity-Based Probe for Cysteine Cathepsins

Current Compound Coverage of the Kinome: Miniperspective

Novel structural hybrids of pyrazolobenzothiazines with benzimidazoles as cholinesterase inhibitors

Extension of three-dimensional activity cliff information through systematic mapping of active analogs

Trispecific antibody targeting HIV-1 and T cells activates and eliminates latently-infected cells in HIV/SHIV infections

Phosphono Bisbenzguanidines as Irreversible Dipeptidomimetic Inhibitors and Activity-Based Probes of Matriptase-2

Identification of sulfonic acids as efficient ecto-5′-nucleotidase inhibitors

Limiting the Number of Potential Binding Modes by Introducing Symmetry into Ligands: Structure-Based Design of Inhibitors for Trypsin-Like Serine Proteases

Synthesis, biological evaluation and molecular docking of N-phenyl thiosemicarbazones as urease inhibitors

Identification and analysis of the currently available high-confidence three-dimensional activity cliffs

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