A. Verras

发表

Discovery of aminoheterocycles as potent and brain penetrant prolylcarboxypeptidase inhibitors.

Michael E. Lassman, Shirly Pinto, M. Garcia-Calvo, 2012, Bioorganic & medicinal chemistry letters.

The discovery of non-benzimidazole and brain-penetrant prolylcarboxypeptidase inhibitors.

Michael E. Lassman, Shirly Pinto, M. Garcia-Calvo, 2012, Bioorganic & medicinal chemistry letters.

A new class of prolylcarboxypeptidase inhibitors, part 2: the aminocyclopentanes.

Michael E. Lassman, Shirly Pinto, J. Lisnock, 2012, Bioorganic & medicinal chemistry letters.

Discovery of a new class of potent prolylcarboxypeptidase inhibitors derived from alanine.

Michael E. Lassman, Shirly Pinto, M. Garcia-Calvo, 2012, Bioorganic & medicinal chemistry letters.

Discovery of benzimidazole pyrrolidinyl amides as prolylcarboxypeptidase inhibitors.

Michael E. Lassman, Shirly Pinto, M. Garcia-Calvo, 2011, Bioorganic & medicinal chemistry letters.

Peptidomic profiling of human cerebrospinal fluid identifies YPRPIHPA as a novel substrate for prolylcarboxypeptidase

Michael E. Lassman, Shirly Pinto, N. Yates, 2010, Proteomics.

Discovery and Pharmacology of a Novel Class of Diacylglycerol Acyltransferase 2 Inhibitors.

Shirly Pinto, D. McLaren, Sheng-ping Wang, 2015, Journal of medicinal chemistry.

Optimization and Mechanistic Investigations of Novel Allosteric Activators of PKG1α.

P. McEwan, Yeon-Hee Lim, A. Cheng, 2022, Journal of medicinal chemistry.

Acute megakaryoblastic leukemia in early childhood.

W. Chan, R. Brynes, A. Verras, 1983, Blood.

Synthesis of oxaspiropiperidines as a strategy for lowering log D

R. DeVita, R. Nargund, J. Balkovec, 2011 .

Identification and Characterization of Sebaceous Gland Atrophy-Sparing DGAT1 Inhibitors

Guanghui Hu, Hua V. Lin, Shirly Pinto, 2014, PloS one.

Benzimidazole-based DGAT1 inhibitors with a [3.1.0] bicyclohexane carboxylic acid moiety.

Shirly Pinto, M. Reibarkh, R. DeVita, 2019, Bioorganic & medicinal chemistry letters.

Development of indazole mineralocorticoid receptor antagonists and investigation into their selective late-stage functionalization.

K. Houk, J. Madwed, R. DeVita, 2019, Bioorganic & medicinal chemistry letters.

Computer-assisted design of selective imidazole inhibitors for cytochrome p450 enzymes.

I. Kuntz, P. Ortiz de Montellano, A. Verras, 2004, Journal of medicinal chemistry.

Mutagenesis and Functional Studies with Succinate Dehydrogenase Inhibitors in the Wheat Pathogen Mycosphaerella graminicola

M. Csukai, A. Verras, Torsten Luksch, 2012, PloS one.

Accelerating the discovery of DGAT1 inhibitors through the application of parallel medicinal chemistry (PMC).

Shirly Pinto, R. Nargund, P. Váchal, 2019, Bioorganic & medicinal chemistry letters.

Structural basis for isoform-specific inhibition of human CTPS1

Steven K. Albanese, J. McElwee, K. Borrelli, 2021, Proceedings of the National Academy of Sciences.

MAIP: a web service for predicting blood‐stage malaria inhibitors

A. Leach, Preeti Iyer, D. Green, 2020, Journal of Cheminformatics.

MAIP: A Prediction Platform for Predicting Blood-Stage Malaria Inhibitors

A. Leach, Preeti Iyer, D. Green, 2020 .

Is Multitask Deep Learning Practical for Pharma?

Andreas Verras, Bharath Ramsundar, Robert P Sheridan, 2017, J. Chem. Inf. Model..

Discovery of Chromane Propionic Acid Analogues as Selective Agonists of GPR120 with in Vivo Activity in Rodents.

Charles L. Jayne, F. Ujjainwalla, T. Akiyama, 2017, ACS medicinal chemistry letters.

Shapes, softness, and nonyrast collectivity in W186

A. Hayes, M. Carpenter, C. Chiara, 2021, Physical Review C.

Pyrazoles as non-classical bioisosteres in prolylcarboxypeptidase (PrCP) inhibitors.

Shirly Pinto, J. Lisnock, M. Garcia-Calvo, 2014, Bioorganic & medicinal chemistry letters.

Discovery and optimization of orally active cyclohexane-based prolylcarboxypeptidase (PrCP) inhibitors.

Shirly Pinto, J. Lisnock, M. Garcia-Calvo, 2013, Bioorganic & medicinal chemistry letters.

A new class of prolylcarboxypeptidase inhibitors, part 1: discovery and evaluation.

Michael E. Lassman, Shirly Pinto, J. Lisnock, 2012, Bioorganic & medicinal chemistry letters.

Discovery of the First Non-cGMP Mimetic Small Molecule Activators of cGMP-Dependent Protein Kinase 1 α (PKG1α).

Gregory T O'Donnell, Lei Zhang, P. Tawa, 2021, ACS medicinal chemistry letters.

AquaLite bioluminescence assay of thyrotropin in serum evaluated.

D. Sgoutas, A. Verras, A. Love, 1995, Clinical chemistry.

Microscale High-Throughput Experimentation as an Enabling Technology in Drug Discovery: Application in the Discovery of (Piperidinyl)pyridinyl-1H-benzimidazole Diacylglycerol Acyltransferase 1 Inhibitors.

Andreas Verras, Yang Yu, Edward C Sherer, 2017, Journal of medicinal chemistry.

Informing the Selection of Screening Hit Series with in Silico Absorption, Distribution, Metabolism, Excretion, and Toxicity Profiles.

Andreas Verras, Robert P Sheridan, J Christopher Culberson, 2017, Journal of medicinal chemistry.

Chapter 10 Cytochrome P450 Enzymes: Computational Approaches to Substrate Prediction

I. Kuntz, A. Verras, P. R. Montellano, 2006 .

Discovery of indazole aldosterone synthase (CYP11B2) inhibitors as potential treatments for hypertension.

M. Struthers, D. Macneil, D. Cully, 2017, Bioorganic & medicinal chemistry letters.

Discovery of Triazole CYP11B2 Inhibitors with in Vivo Activity in Rhesus Monkeys.

Michael E. Lassman, M. Struthers, Qingzhong Hu, 2015, ACS medicinal chemistry letters.

Discovery of Benzimidazole CYP11B2 Inhibitors with in Vivo Activity in Rhesus Monkeys.

Michael E. Lassman, Jeffrey T. Kuethe, M. Struthers, 2015, ACS medicinal chemistry letters.

Shared Consensus Machine Learning Models for Predicting Blood Stage Malaria Inhibition

Julie Clark, Andreas Verras, Chris L. Waller, 2017, J. Chem. Inf. Model..

Cytochrome P450 active site plasticity: attenuation of imidazole binding in cytochrome P450(cam) by an L244A mutation.

A. Alian, A. Verras, P. D. de Montellano, 2006, Protein engineering, design & selection : PEDS.

Performance of multiple docking and refinement methods in the pose prediction D3R prospective Grand Challenge 2016

Andreas Verras, Xavier Fradera, Hongwu Wang, 2017, Journal of Computer-Aided Molecular Design.

Discovery of Spirocyclic Aldosterone Synthase Inhibitors as Potential Treatments for Resistant Hypertension.

M. Struthers, D. Macneil, D. Cully, 2017, ACS medicinal chemistry letters.

Discovery of benzodihydroisofurans as novel, potent, bioavailable and brain-penetrant prolylcarboxypeptidase inhibitors.

Michael E. Lassman, Shirly Pinto, M. Garcia-Calvo, 2012, Bioorganic & medicinal chemistry letters.

Workflows and performances in the ranking prediction of 2016 D3R Grand Challenge 2: lessons learned from a collaborative effort

Yuan Hu, Andreas Verras, Hongwu Wang, 2017, Journal of Computer-Aided Molecular Design.

QSAR Prediction of Passive Permeability in the LLC‐PK1 Cell Line: Trends in Molecular Properties and Cross‐Prediction of Caco‐2 Permeabilities

Andreas Verras, Robert P Sheridan, Edward C Sherer, 2012, Molecular informatics.