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Title | Design and Synthesis of Novel Spiro Derivatives as Potent and Reversible Monoacylglycerol Lipase (MAGL) Inhibitors: Bioisosteric Transformation from 3-Oxo-3,4-dihydro-2 H -benzo[ b ][1,4]oxazin-6-yl Moiety. |
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Journal, issue, pages | J. Med. Chem., Vol. 64, Page 11014-11044, Year 2021 |
Publish date | Dec 21, 2020 (structure data deposition date) |
Authors | Ikeda, S. / Sugiyama, H. / Tokuhara, H. / Murakami, M. / Nakamura, M. / Oguro, Y. / Aida, J. / Morishita, N. / Sogabe, S. / Dougan, D.R. ...Ikeda, S. / Sugiyama, H. / Tokuhara, H. / Murakami, M. / Nakamura, M. / Oguro, Y. / Aida, J. / Morishita, N. / Sogabe, S. / Dougan, D.R. / Gay, S.C. / Qin, L. / Arimura, N. / Takahashi, Y. / Sasaki, M. / Kamada, Y. / Aoyama, K. / Kimoto, K. / Kamata, M. |
External links | J. Med. Chem. / PubMed:34328319 |
Methods | X-ray diffraction |
Resolution | 2.2 - 2.3 Å |
Structure data | PDB-7l4t: PDB-7l4u: PDB-7l4w: PDB-7l50: |
Chemicals | ChemComp-XPD: ChemComp-ACT: ChemComp-MPD: ChemComp-HOH: ChemComp-XP7: ChemComp-CL: ChemComp-XOV: ChemComp-XOM: |
Source |
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Keywords | HYDROLASE/INHIBITOR / Inhibitor / Serine hydrolase / HYDROLASE / HYDROLASE-INHIBITOR complex |