Application of fragment screening and merging to the discovery of inhibitors of the Mycobacterium tuberculosis cytochrome P450 CYP121.
Department of Chemistry, University of Cambridge, Lensfield Road, Cambridge, CB2 1EW UK.
Sean A
SA
Hudson
Kirsty J
KJ
McLean
Sachin
S
Surade
Yong-Qing
YQ
Yang
David
D
Leys
Alessio
A
Ciulli
Andrew W
AW
Munro
Chris
C
Abell
D001426:Bacterial Proteins / Q000037:antagonists & inhibitors* / Q000378:metabolism; D001665:Binding Sites; D018360:Crystallography, X-Ray; D003512:Cyclohexanones / Q000737:chemistry; D065607:Cytochrome P-450 Enzyme Inhibitors; D003577:Cytochrome P-450 Enzyme System / Q000378:metabolism; D015195:Drug Design; D004353:Drug Evaluation, Preclinical; D008024:Ligands; D009169:Mycobacterium tuberculosis / Q000378:metabolism*; D017434:Protein Structure, Tertiary; D013329:Structure-Activity Relationship
D001426:Bacterial Proteins; D003512:Cyclohexanones; D065607:Cytochrome P-450 Enzyme Inhibitors; D008024:Ligands; C464825:cytochrome P-450 CYP121; C036468:cyclohexanone; D003577:Cytochrome P-450 Enzyme System