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Title | Biologic-like In Vivo Efficacy with Small Molecule Inhibitors of TNF alpha Identified Using Scaffold Hopping and Structure-Based Drug Design Approaches. |
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Journal, issue, pages | J. Med. Chem., Vol. 63, Page 15050-15071, Year 2020 |
Publish date | Aug 11, 2020 (structure data deposition date) |
Authors | Xiao, H.Y. / Li, N. / Duan, J.J. / Jiang, B. / Lu, Z. / Ngu, K. / Tino, J. / Kopcho, L.M. / Lu, H. / Chen, J. ...Xiao, H.Y. / Li, N. / Duan, J.J. / Jiang, B. / Lu, Z. / Ngu, K. / Tino, J. / Kopcho, L.M. / Lu, H. / Chen, J. / Tebben, A.J. / Sheriff, S. / Chang, C.Y. / Yanchunas Jr., J. / Calambur, D. / Gao, M. / Shuster, D.J. / Susulic, V. / Xie, J.H. / Guarino, V.R. / Wu, D.R. / Gregor, K.R. / Goldstine, C.B. / Hynes Jr., J. / Macor, J.E. / Salter-Cid, L. / Burke, J.R. / Shaw, P.J. / Dhar, T.G.M. |
External links | J. Med. Chem. / PubMed:33261314 |
Methods | X-ray diffraction |
Resolution | 2.1 Å |
Structure data | PDB-7jra: |
Chemicals | ChemComp-VGY: ChemComp-GOL: ChemComp-HOH: |
Source |
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Keywords | CYTOKINE / TUMOR NECROSIS FACTOR ALPHA / TNF / ASYMMETRIC / PROTEIN-PROTEIN INTERACTION INHIBITOR / INHIBITOR / LYMPHOKINE |