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-Structure paper
Title | Structure-guided optimization of 3-hydroxybenzoisoxazole derivatives as inhibitors of Aldo-keto reductase 1C3 (AKR1C3) to target prostate cancer. |
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Journal, issue, pages | Eur. J. Med. Chem., Vol. 268, Page 116193-116193, Year 2024 |
Publish date | Dec 3, 2023 (structure data deposition date) |
Authors | Pippione, A.C. / Kovachka, S. / Vigato, C. / Bertarini, L. / Mannella, I. / Sainas, S. / Rolando, B. / Denasio, E. / Piercy-Mycock, H. / Romalho, L. ...Pippione, A.C. / Kovachka, S. / Vigato, C. / Bertarini, L. / Mannella, I. / Sainas, S. / Rolando, B. / Denasio, E. / Piercy-Mycock, H. / Romalho, L. / Salladini, E. / Adinolfi, S. / Zonari, D. / Peraldo-Neia, C. / Chiorino, G. / Passoni, A. / Mirza, O.A. / Frydenvang, K. / Pors, K. / Lolli, M.L. / Spyrakis, F. / Oliaro-Bosso, S. / Boschi, D. |
External links | Eur. J. Med. Chem. / PubMed:38364714 |
Methods | X-ray diffraction |
Resolution | 2 Å |
Structure data | PDB-8rb6: |
Chemicals | ChemComp-NAP:
ChemComp-YMC: ChemComp-EDO: ChemComp-HOH: |
Source |
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Keywords | OXIDOREDUCTASE / Aldo-keto reductase / AKR1C3 / inhibitor |