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Discovery of a new series of PI3K-δ inhibitors from Virtual Screening

Bioorganic & medicinal chemistry letters, 2021-06, Vol.42, p.128046-128046, Article 128046

2021

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Discovery of new acetylcholinesterase inhibitors with small core structures through shape-based virtual screening

Bioorganic & medicinal chemistry letters, 2015-09, Vol.25 (17), p.3442-3446

2015

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Discovery and structure-based design of a new series of potent and selective PPARδ agonists utilizing a virtual screening method

Bioorganic & medicinal chemistry letters, 2022-03, Vol.59, p.128567-128567, Article 128567

2022

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Learning from our mistakes: The ‘unknown knowns’ in fragment screening

Bioorganic & medicinal chemistry letters, 2013-05, Vol.23 (10), p.2844-2852

2013

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Recent advances on the encoding and selection methods of DNA-encoded chemical library

Bioorganic & medicinal chemistry letters, 2017-02, Vol.27 (3), p.361-369

2017

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Biological activity evaluation and structure–activity relationships analysis of ferulic acid and caffeic acid derivatives for anticancer

Bioorganic & medicinal chemistry letters, 2012-10, Vol.22 (19), p.6085-6088

2012

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Design and biological evaluation of imidazo[1,2-a]pyridines as novel and potent ASK1 inhibitors

Bioorganic & medicinal chemistry letters, 2012-12, Vol.22 (24), p.7326-7329

2012

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Development of small-molecule probes that selectively kill cells induced to express mutant RAS

Bioorganic & medicinal chemistry letters, 2012-02, Vol.22 (4), p.1822-1826

2012

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Advances in Lead Generation

Bioorganic & medicinal chemistry letters, 2019-02, Vol.29 (4), p.517-524

2019

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Inhibitors of the Yersinia protein tyrosine phosphatase through high throughput and virtual screening approaches

Bioorganic & medicinal chemistry letters, 2013-02, Vol.23 (4), p.1056-1062

2013

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Discovery of BRD4 bromodomain inhibitors by fragment-based high-throughput docking

Bioorganic & medicinal chemistry letters, 2014-06, Vol.24 (11), p.2493-2496

2014

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Identification of two novel chemical classes of Autotaxin (ATX) inhibitors using Enalos Asclepios KNIME nodes

Bioorganic & medicinal chemistry letters, 2024-05, Vol.103, p.129690-129690, Article 129690

2024

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Discovery of potent antiproliferative agents from selected oxygen heterocycles as EGFR tyrosine kinase inhibitors from the U.S. National Cancer Institute database by in silico screening and bioactivity evaluation

Bioorganic & medicinal chemistry letters, 2022-02, Vol.58, p.128524-128524, Article 128524

2022

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Virtual screening to identify potent sepiapterin reductase inhibitors

Bioorganic & medicinal chemistry letters, 2020-01, Vol.30 (2), p.126793-126793, Article 126793

2020

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Discovery of small molecule inhibitors of human uridine-cytidine kinase 2 by high-throughput screening

Bioorganic & medicinal chemistry letters, 2019-09, Vol.29 (18), p.2559-2564

2019

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Discovery and optimization of a series of 2-aminothiazole-oxazoles as potent phosphoinositide 3-kinase [gamma] inhibitors

Bioorganic & medicinal chemistry letters, 2012-12, Vol.22 (24), p.7534-7538

2012

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Identification, optimisation and in vivo evaluation of oxadiazole DGAT-1 inhibitors for the treatment of obesity and diabetes

Bioorganic & medicinal chemistry letters, 2012-06, Vol.22 (12), p.3873-3878

2012

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Discovery of a potent and selective adenylyl cyclase type 8 agonist by docking-based virtual screening

Bioorganic & medicinal chemistry letters, 2020-01, Vol.30 (2), p.126823-126823, Article 126823

2020

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Virtual screening for early identification of potent and selective histone deacetylase 6 inhibitor series

Bioorganic & medicinal chemistry letters, 2023-11, Vol.96, p.129537, Article 129537

2023

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4-Pyridone-3-carboxylic acid as a benzoic acid bioisostere: Design, synthesis, and evaluation of EP300/CBP histone acetyltransferase inhibitors

Bioorganic & medicinal chemistry letters, 2021-11, Vol.51, p.128358-128358, Article 128358

2021

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Structure-based Design of Novel Hepatitis B Virus Capsid Assembly Modulators

Bioorganic & medicinal chemistry letters, 2023-09, Vol.93, p.129412-129412, Article 129412

2023

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Discovery of JMJD7 inhibitors with the aid of virtual screening and bioactivity evaluation

Bioorganic & medicinal chemistry letters, 2021-08, Vol.45, p.128139-128139, Article 128139

2021

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Synthesis, biological evaluation and molecular modeling study of some new methoxylated 2-benzylthio-quinazoline-4(3H)-ones as nonclassical antifolates

Bioorganic & medicinal chemistry letters, 2016-10, Vol.26 (19), p.4815-4823

2016

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Identification of novel SIRT3 inhibitor scaffolds by virtual screening

Bioorganic & medicinal chemistry letters, 2013-05, Vol.23 (10), p.2990-2995

2013

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Virtual screening and biophysical studies lead to HSP90 inhibitors

Bioorganic & medicinal chemistry letters, 2017-01, Vol.27 (2), p.277-281

2017

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Discovery of a new series of PI3K-δ inhibitors from Virtual Screening

Discovery of new acetylcholinesterase inhibitors with small core structures through shape-based virtual screening

Discovery and structure-based design of a new series of potent and selective PPARδ agonists utilizing a virtual screening method

Learning from our mistakes: The ‘unknown knowns’ in fragment screening

Recent advances on the encoding and selection methods of DNA-encoded chemical library

Biological activity evaluation and structure–activity relationships analysis of ferulic acid and caffeic acid derivatives for anticancer

Design and biological evaluation of imidazo[1,2-a]pyridines as novel and potent ASK1 inhibitors

Development of small-molecule probes that selectively kill cells induced to express mutant RAS

Advances in Lead Generation

Inhibitors of the Yersinia protein tyrosine phosphatase through high throughput and virtual screening approaches

Discovery of BRD4 bromodomain inhibitors by fragment-based high-throughput docking

Identification of two novel chemical classes of Autotaxin (ATX) inhibitors using Enalos Asclepios KNIME nodes

Discovery of potent antiproliferative agents from selected oxygen heterocycles as EGFR tyrosine kinase inhibitors from the U.S. National Cancer Institute database by in silico screening and bioactivity evaluation

Virtual screening to identify potent sepiapterin reductase inhibitors

Discovery of small molecule inhibitors of human uridine-cytidine kinase 2 by high-throughput screening

Discovery and optimization of a series of 2-aminothiazole-oxazoles as potent phosphoinositide 3-kinase [gamma] inhibitors

Identification, optimisation and in vivo evaluation of oxadiazole DGAT-1 inhibitors for the treatment of obesity and diabetes

Discovery of a potent and selective adenylyl cyclase type 8 agonist by docking-based virtual screening

Virtual screening for early identification of potent and selective histone deacetylase 6 inhibitor series

4-Pyridone-3-carboxylic acid as a benzoic acid bioisostere: Design, synthesis, and evaluation of EP300/CBP histone acetyltransferase inhibitors

Structure-based Design of Novel Hepatitis B Virus Capsid Assembly Modulators

Discovery of JMJD7 inhibitors with the aid of virtual screening and bioactivity evaluation

Synthesis, biological evaluation and molecular modeling study of some new methoxylated 2-benzylthio-quinazoline-4(3H)-ones as nonclassical antifolates

Identification of novel SIRT3 inhibitor scaffolds by virtual screening

Virtual screening and biophysical studies lead to HSP90 inhibitors

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