Evaluation of a 3-amino-8-azabicyclo[3.2.1]octane replacement in the CCR5 antagonist maraviroc

Bioorganic and Medicinal Chemistry Letters

Volumn 20, Issue 5, 2010, Pages 1674-1676

  Lemoine, Rémy C ^a   Petersen, Ann C ^a   Setti, Lina ^a   Baldinger, Thomas ^a   Wanner, Jutta ^a   Jekle, Andreas ^a   Heilek, Gabrielle ^a   deRosier, André ^a   Ji, Changhua ^a   Rotstein, David M ^a  

^a Roche Palo Alto ^*  (United States)

Author keywords

3 Amino 8 azabicyclo 3.2.1 octane; 5 Amino 3 azabicyclo 3.3.0 octane; CCR5 antagonist; Maraviroc; Replacement

Indexed keywords

3 AMINO 8 AZABICYCLO[3.2.1]OCTANE; ANTIVIRUS AGENT; MARAVIROC; UNCLASSIFIED DRUG;

ANTIVIRAL ACTIVITY; ARTICLE; DRUG INHIBITION; DRUG SCREENING; DRUG STRUCTURE;

ANTI-HIV AGENTS; AZABICYCLO COMPOUNDS; CELL LINE, TUMOR; CYCLOHEXANES; HIV FUSION INHIBITORS; HUMANS; MODELS, CHEMICAL; RECEPTORS, CCR5; TRIAZOLES;

EID: 76749146371     PISSN: 0960894X     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.bmcl.2010.01.080     Document Type: Article

References (9)

1. Lemoine, R.; Wanner, J. Curr. Topics Med. Chem., in press.
2. moe software version 2006.08 available from the Chemical Computing Group Inc., 1010 Sherbrooke Street West, Montreal, Quebec, Canada [www.chemcomp.com].
3. maestro software version 8.5 available from Schrodinger Software Inc., 101 SW Main Street Suite 1300, Portland, OR 97204, USA [www.schrodinger.com].
4. as values were calculated using Moka Linux version 20090616 T.
5. Lee H.-Y., An M., and Sohn J.-H. Bull. Korean Chem. Soc. 24 (2003) 539
6. Stupple, P. A. PCT Int. Appl. WO2005033107.
7. For details on these assays, please see: Melville, C. R.; Rotstein, D. M. PCT Int. Appl. WO2008119663.
8. Wood A., and Armour D. Prog. Med. Chem. 43 (2005) 239
9. Rotstein, D. M.; Melville, C. R.; Padilla, F.; Cournoyer, D.; Lee, E. K.; Lemoine, R.; Petersen, A. Setti, L. Q.; Wanner, J.; Chen, L.; Filonova, L.; Loughhead, D.; Manka, J.; Lin, X.-F.; Gleason, S.; Sankuratri, S.; Ji, C.; de Rosier, A.; Dioszegi, M.; Heilek, G.; Jekle, A.; Berry, P.; Mau, C.-I.; Weller, P. Bioorg. Med. Chem. Lett., in preparation.