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Title | Discovery of a 3-(4-Pyrimidinyl) Indazole (MLi-2), an Orally Available and Selective Leucine-Rich Repeat Kinase 2 (LRRK2) Inhibitor that Reduces Brain Kinase Activity. |
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Journal, issue, pages | J. Med. Chem., Vol. 60, Page 2983-2992, Year 2017 |
Publish date | Dec 8, 2016 (structure data deposition date) |
Authors | Scott, J.D. / DeMong, D.E. / Greshock, T.J. / Basu, K. / Dai, X. / Harris, J. / Hruza, A. / Li, S.W. / Lin, S.I. / Liu, H. ...Scott, J.D. / DeMong, D.E. / Greshock, T.J. / Basu, K. / Dai, X. / Harris, J. / Hruza, A. / Li, S.W. / Lin, S.I. / Liu, H. / Macala, M.K. / Hu, Z. / Mei, H. / Zhang, H. / Walsh, P. / Poirier, M. / Shi, Z.C. / Xiao, L. / Agnihotri, G. / Baptista, M.A. / Columbus, J. / Fell, M.J. / Hyde, L.A. / Kuvelkar, R. / Lin, Y. / Mirescu, C. / Morrow, J.A. / Yin, Z. / Zhang, X. / Zhou, X. / Chang, R.K. / Embrey, M.W. / Sanders, J.M. / Tiscia, H.E. / Drolet, R.E. / Kern, J.T. / Sur, S.M. / Renger, J.J. / Bilodeau, M.T. / Kennedy, M.E. / Parker, E.M. / Stamford, A.W. / Nargund, R. / McCauley, J.A. / Miller, M.W. |
External links | J. Med. Chem. / PubMed:28245354 |
Methods | X-ray diffraction |
Resolution | 1.69 Å |
Structure data | PDB-5u6i: |
Chemicals | ChemComp-81Y: ChemComp-SO4: ChemComp-HOH: |
Source |
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Keywords | TRANSFERASE/TRANSFERASE INHIBITOR / MLi-2 / LRRK2 / kinase inhibitor / kinase selectivity / Parkinson's disease / TRANSFERASE / SERINE/ THREONINE-PROTEIN KINASE / MAP KINASE / TRANSFERASE-TRANSFERASE INHIBITOR COMPLEX |