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Assay Detail

CHEMBL655571

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

Binding
IC50 value against Prostaglandin G/H synthase 2 of murine J774A.1 cell line
34
Total Activities
34
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Confidence 8 — Homologous single protein target
Curated By Expert

Target

Prostaglandin G/H synthase 2 (CHEMBL4321)
Type SINGLE PROTEIN
Organism Mus musculus

Publication

Synthesis, structure-activity relationships, and in vivo evaluations of substituted di-tert-butylphenols as a novel class of potent, selective, and orally active cyclooxygenase-2 inhibitors. 2. 1,3,4- and 1,2,4-thiadiazole series.
Song Y, Connor DT, Sercel AD, Sorenson RJ, Doubleday R, Unangst PC, Roth BD, Beylin VG, Gilbertsen RB, Chan K, Schrier DJ, Guglietta A, Bornemeier DA, Dyer RD.
J Med Chem (1999) 42 : 1161 -1169
PubMed 10197960 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 34 6.82 8.19

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL6 INDOMETHACIN 4.0 1 8.19
CHEMBL12532 1 8.05
CHEMBL280326 1 7.92
CHEMBL16819 1 7.82
CHEMBL17218 1 7.75
CHEMBL279308 1 7.75
CHEMBL7162 NS-398 1 7.66
CHEMBL275188 1 7.58
CHEMBL17229 1 7.58
CHEMBL16733 1 7.16
CHEMBL274990 SC-58125 1 7.16
CHEMBL417073 1 6.96
CHEMBL274457 1 6.85
CHEMBL279801 1 6.75
CHEMBL16826 1 6.68
CHEMBL16843 1 6.64
CHEMBL16827 1 6.62
CHEMBL16912 1 6.58
CHEMBL16828 1 6.52
CHEMBL16878 1 6.48
CHEMBL16659 1 6.46
CHEMBL16814 1 6.41
CHEMBL279755 1 6.16
CHEMBL276916 1 6.04
CHEMBL276062 1 5.89
CHEMBL16981 1 5.85
CHEMBL278040 1 5.82
CHEMBL16891 1 5.43
CHEMBL16674 1 5.07
CHEMBL273793 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL6 INDOMETHACIN IC50 = 6.4 nM 8.19
CHEMBL12532 IC50 = 9.0 nM 8.05
CHEMBL280326 IC50 = 12.0 nM 7.92
CHEMBL16819 IC50 = 15.0 nM 7.82
CHEMBL17218 IC50 = 18.0 nM 7.75
CHEMBL279308 IC50 = 18.0 nM 7.75
CHEMBL7162 NS-398 IC50 = 22.0 nM 7.66
CHEMBL275188 IC50 = 26.0 nM 7.58
CHEMBL17229 IC50 = 26.0 nM 7.58
CHEMBL16733 IC50 = 70.0 nM 7.16
CHEMBL274990 SC-58125 IC50 = 70.0 nM 7.16
CHEMBL417073 IC50 = 110.0 nM 6.96
CHEMBL274457 IC50 = 140.0 nM 6.85
CHEMBL279801 IC50 = 180.0 nM 6.75
CHEMBL16826 IC50 = 210.0 nM 6.68
CHEMBL16843 IC50 = 230.0 nM 6.64
CHEMBL16827 IC50 = 240.0 nM 6.62
CHEMBL16912 IC50 = 260.0 nM 6.58
CHEMBL16828 IC50 = 300.0 nM 6.52
CHEMBL16878 IC50 = 330.0 nM 6.48
CHEMBL16659 IC50 = 350.0 nM 6.46
CHEMBL16814 IC50 = 390.0 nM 6.41
CHEMBL279755 IC50 = 690.0 nM 6.16
CHEMBL276916 IC50 = 920.0 nM 6.04
CHEMBL276062 IC50 = 1300.0 nM 5.89
CHEMBL16981 IC50 = 1400.0 nM 5.85
CHEMBL278040 IC50 = 1500.0 nM 5.82
CHEMBL16891 IC50 = 3700.0 nM 5.43
CHEMBL16674 IC50 = 8500.0 nM 5.07
CHEMBL273793 IC50 > 20000.0 nM -
CHEMBL17104 IC50 > 20000.0 nM -
CHEMBL279336 IC50 > 20000.0 nM -
CHEMBL16977 IC50 > 20000.0 nM -
CHEMBL416165 IC50 > 20000.0 nM -