Discovery of a new cyclooxygenase-2 lead compound through 3-D database searching and combinatorial chemistry.
Using a combination of computational and combinatorial chemistry methodologies, a phenothiazine compound was discovered that is a selective inhibitor of cyclooxygenase-2 and serves as a lead compound for a potentially novel series of anti-inflammatory compounds.
Stewart
K D
KD
Department of Advanced Technologa, Abbott Laboratories, Abbott Park, IL 60064, USA.
Loren
S
S
Frey
L
L
Otis
E
E
Klinghofer
V
V
Hulkower
K I
KI
D001665:Binding Sites; D051546:Cyclooxygenase 2; D003628:Database Management Systems; D007527:Isoenzymes / Q000737:chemistry*; D011451:Prostaglandin-Endoperoxide Synthases / Q000737:chemistry*; D011487:Protein Conformation
D007527:Isoenzymes; D051546:Cyclooxygenase 2; D011451:Prostaglandin-Endoperoxide Synthases