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TitleIdentification of CNS-Penetrant Aryl Sulfonamides as Isoform-Selective NaV1.6 Inhibitors with Efficacy in Mouse Models of Epilepsy.
Journal, issue, pagesJ. Med. Chem., Vol. 62, Page 9618-9641, Year 2019
Publish dateJun 26, 2019 (structure data deposition date)
AuthorsFocken, T. / Burford, K. / Grimwood, M.E. / Zenova, A. / Andrez, J.C. / Gong, W. / Wilson, M. / Taron, M. / Decker, S. / Lofstrand, V. ...Focken, T. / Burford, K. / Grimwood, M.E. / Zenova, A. / Andrez, J.C. / Gong, W. / Wilson, M. / Taron, M. / Decker, S. / Lofstrand, V. / Chowdhury, S. / Shuart, N. / Lin, S. / Goodchild, S.J. / Young, C. / Soriano, M. / Tari, P.K. / Waldbrook, M. / Nelkenbrecher, K. / Kwan, R. / Lindgren, A. / de Boer, G. / Lee, S. / Sojo, L. / DeVita, R.J. / Cohen, C.J. / Wesolowski, S.S. / Johnson Jr., J.P. / Dehnhardt, C.M. / Empfield, J.R.
External linksJ. Med. Chem. / PubMed:31525968
MethodsX-ray diffraction
Resolution2.7 Å
Structure data

PDB-6s41:
CRYSTAL STRUCTURE OF PXR IN COMPLEX WITH XPC-7455
Method: X-RAY DIFFRACTION / Resolution: 2.7 Å

Chemicals

ChemComp-KUB:
4-[[(1~{S})-1-[2,5-bis(fluoranyl)phenyl]ethyl]amino]-5-chloranyl-2-fluoranyl-~{N}-(1,3-thiazol-4-yl)benzenesulfonamide

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsNUCLEAR PROTEIN / PREGNANE X RECEPTOR / NUCLEAR RECEPTOR

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