Synthesis and characterisation of 5-acyl-6,7-dihydrothieno[3,2-c]pyridine inhibitors of Hedgehog acyltransferase

Thomas Lanyon-Hogg; Naoko Masumoto; George Bodakh; Antonio D. Konitsiotis; Emmanuelle Thinon; Ursula R. Rodgers; Raymond J. Owens; Anthony I. Magee; Edward W. Tate

Data in Brief (Jun 2016)

Synthesis and characterisation of 5-acyl-6,7-dihydrothieno[3,2-c]pyridine inhibitors of Hedgehog acyltransferase

Thomas Lanyon-Hogg,
Naoko Masumoto,
George Bodakh,
Antonio D. Konitsiotis,
Emmanuelle Thinon,
Ursula R. Rodgers,
Raymond J. Owens,
Anthony I. Magee,
Edward W. Tate

Affiliations

Thomas Lanyon-Hogg: Department of Chemistry, Imperial College London, SW7 2AZ, UK; Institute of Chemical Biology, Imperial College London, SW72AZ, UK
Naoko Masumoto: Department of Chemistry, Imperial College London, SW7 2AZ, UK; Institute of Chemical Biology, Imperial College London, SW72AZ, UK
George Bodakh: Department of Chemistry, Imperial College London, SW7 2AZ, UK; Institute of Chemical Biology, Imperial College London, SW72AZ, UK
Antonio D. Konitsiotis: Molecular Medicine Section, National Heart & Lung Institute, Imperial College London, London SW7 2AZ, UK
Emmanuelle Thinon: Department of Chemistry, Imperial College London, SW7 2AZ, UK; Institute of Chemical Biology, Imperial College London, SW72AZ, UK
Ursula R. Rodgers: Molecular Medicine Section, National Heart & Lung Institute, Imperial College London, London SW7 2AZ, UK
Raymond J. Owens: Oxford Protein Production Facility UK, The Research Complex at Harwell, Rutherford Appleton Laboratory, Harwell Science & Innovation Centre, Harwell OX11 0FA, UK
Anthony I. Magee: Molecular Medicine Section, National Heart & Lung Institute, Imperial College London, London SW7 2AZ, UK; Corresponding author at: Molecular Medicine Section, National Heart & Lung Institute, Imperial College London, London SW7 2AZ, UK. Tel.: +44 20 7594 3135.
Edward W. Tate: Department of Chemistry, Imperial College London, SW7 2AZ, UK; Institute of Chemical Biology, Imperial College London, SW72AZ, UK; Corresponding author at: Institute of Chemical Biology, Department of Chemistry, Imperial College London, London SW7 2AZ, UK. Tel.: +44 20 7594 3752.

Journal volume & issue: Vol. 7
pp. 257 – 281

Abstract

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In this data article we describe synthetic and characterisation data for four members of the 5-acyl-6,7-dihydrothieno[3,2-c]pyridine (termed “RU-SKI”) class of inhibitors of Hedgehog acyltransferase, including associated NMR spectra for final compounds. RU-SKI compounds were selected for synthesis based on their published high potencies against the enzyme target. RU-SKI 41 (9a), RU-SKI 43 (9b), RU-SKI 101 (9c), and RU-SKI 201 (9d) were profiled for activity in the related article “Click chemistry armed enzyme linked immunosorbent assay to measure palmitoylation by Hedgehog acyltransferase” (Lanyon-Hogg et al., 2015) [1]. 1H NMR spectral data indicate different amide conformational ratios between the RU-SKI inhibitors, as has been observed in other 5-acyl-6,7-dihydrothieno[3,2-c]pyridines. The synthetic and characterisation data supplied in the current article provide validated access to the class of RU-SKI inhibitors. Keywords: Synthesis, Inhibitors, Hedgehog acyltransferase, Conformation

Published in Data in Brief

ISSN: 2352-3409 (Online)
Publisher: Elsevier
Country of publisher: United States
LCC subjects: Medicine: Medicine (General): Computer applications to medicine. Medical informatics; Science: Science (General)
Website: http://www.journals.elsevier.com/data-in-brief/

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