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Assay Detail

CHEMBL1059944

Review assay metadata, readout intent, target linkage, and publication context from the same page.

Binding
Inhibition of human COX2 expressed in baculovirus-infected SF9 cells assessed as inhibition of arachidonic acid-stimulated PGE2 production treated 1 hr before arachidonic acid challenge by enzyme immunoassay
16
Total Activities
16
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type Sf9
Confidence 9 — Direct single protein target
Curated By Intermediate

Target

Prostaglandin G/H synthase 2 (CHEMBL230)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Identification of [4-[4-(methylsulfonyl)phenyl]-6-(trifluoromethyl)-2-pyrimidinyl] amines and ethers as potent and selective cyclooxygenase-2 inhibitors.
Swarbrick ME, Beswick PJ, Gleave RJ, Green RH, Bingham S, Bountra C, Carter MC, Chambers LJ, Chessell IP, Clayton NM, Collins SD, Corfield JA, Hartley CD, Kleanthous S, Lambeth PF, Lucas FS, Mathews N, Naylor A, Page LW, Payne JJ, Pegg NA, Price HS, Skidmore J, Stevens AJ, Stocker R, Stratton SC, Stuart AJ, Wiseman JO.
Bioorg Med Chem Lett (2009) 19 : 4504 -4508
PubMed 19520573 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 16 7.27 7.92

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL539663 1 7.92
CHEMBL550126 1 7.67
CHEMBL551419 1 7.66
CHEMBL550537 1 7.48
CHEMBL564729 1 7.35
CHEMBL551017 1 7.20
CHEMBL118 CELECOXIB 4.0 1 7.20
CHEMBL122 ROFECOXIB 4.0 1 6.97
CHEMBL558929 1 5.99
CHEMBL552082 1 -
CHEMBL561005 1 -
CHEMBL552081 1 -
CHEMBL551418 1 -
CHEMBL562791 1 -
CHEMBL550737 1 -
CHEMBL564993 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL539663 IC50 = 12.0 nM 7.92
CHEMBL550126 IC50 = 21.5 nM 7.67
CHEMBL551419 IC50 = 22.0 nM 7.66
CHEMBL550537 IC50 = 33.0 nM 7.48
CHEMBL564729 IC50 = 45.0 nM 7.35
CHEMBL551017 IC50 = 63.0 nM 7.20
CHEMBL118 CELECOXIB IC50 = 63.0 nM 7.20
CHEMBL122 ROFECOXIB IC50 = 107.0 nM 6.97
CHEMBL558929 IC50 = 1034.0 nM 5.99
CHEMBL552082 IC50 < 10.0 nM -
CHEMBL561005 IC50 < 10.0 nM -
CHEMBL552081 IC50 < 10.0 nM -
CHEMBL551418 IC50 < 10.0 nM -
CHEMBL562791 IC50 < 10.0 nM -
CHEMBL550737 IC50 < 10.0 nM -
CHEMBL564993 IC50 < 10.0 nM -