Atropisomeric small molecule Bcl-2 ligands: determination of bioactive conformation.
The separation of atropisomeric conformers of 1,2,3,4-tetrahydroisoquinoline amide Bcl-2 ligands allowed the identification of the bioactive conformer which was subsequently confirmed by X-ray crystallography.
Porter
John
J
UCB Celltech, 216 Bath Road, Slough SL1 3WE, UK.
Payne
Andrew
A
Whitcombe
Ian
I
de Candole
Ben
B
Ford
Daniel
D
Garlish
Rachel
R
Hold
Adam
A
Hutchinson
Brian
B
Trevitt
Graham
G
Turner
James
J
Edwards
Chloe
C
Watkins
Clare
C
Davis
Jeremy
J
Stubberfield
Colin
C
D017209:Apoptosis; D001665:Binding Sites; D002626:Chemistry, Pharmaceutical / Q000379:methods*; D018360:Crystallography, X-Ray / Q000379:methods; D015195:Drug Design; D006801:Humans; D008024:Ligands; D009682:Magnetic Resonance Spectroscopy; D008968:Molecular Conformation; D015394:Molecular Structure; D011485:Protein Binding; D025941:Protein Interaction Mapping; D019253:Proto-Oncogene Proteins c-bcl-2 / Q000737:chemistry*; D013329:Structure-Activity Relationship; D044005:Tetrahydroisoquinolines / Q000737:chemistry*
D008024:Ligands; D019253:Proto-Oncogene Proteins c-bcl-2; D044005:Tetrahydroisoquinolines; C014843:1,2,3,4-tetrahydroisoquinoline