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| Title | Discovery and Characterization of the Potent and Selective P2X4 InhibitorN-[4-(3-Chlorophenoxy)-3-sulfamoylphenyl]-2-phenylacetamide (BAY-1797) and Structure-Guided Amelioration of Its CYP3A4 Induction Profile. |
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| Journal, issue, pages | J. Med. Chem., Vol. 62, Page 11194-11217, Year 2019 |
| Publish date | Oct 5, 2018 (structure data deposition date) |
Authors | Werner, S. / Mesch, S. / Hillig, R.C. / Ter Laak, A. / Klint, J. / Neagoe, I. / Laux-Biehlmann, A. / Dahllof, H. / Brauer, N. / Puetter, V. ...Werner, S. / Mesch, S. / Hillig, R.C. / Ter Laak, A. / Klint, J. / Neagoe, I. / Laux-Biehlmann, A. / Dahllof, H. / Brauer, N. / Puetter, V. / Nubbemeyer, R. / Schulz, S. / Bairlein, M. / Zollner, T.M. / Steinmeyer, A. |
External links | J. Med. Chem. / PubMed:31746599 |
| Methods | X-ray diffraction |
| Resolution | 2.22 Å |
| Structure data | ![]() PDB-6hty: |
| Chemicals | ![]() ChemComp-GOL: ![]() ChemComp-DMS: ![]() ChemComp-GRH: ![]() ChemComp-HOH: |
| Source |
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Keywords | TRANSCRIPTION / PXR / SRC-1 / CYP3A4 Induction |
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