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Assay Detail

CHEMBL772766

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

Binding
In vitro inhibitory concentration required to block recombinant human prostaglandin G/H synthase 1 (COX-1)
109
Total Activities
109
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 1 (CHEMBL221)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Synthesis and biological evaluation of the 1,5-diarylpyrazole class of cyclooxygenase-2 inhibitors: identification of 4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl]benze nesulfonamide (SC-58635, celecoxib).
Penning TD, Talley JJ, Bertenshaw SR, Carter JS, Collins PW, Docter S, Graneto MJ, Lee LF, Malecha JW, Miyashiro JM, Rogers RS, Rogier DJ, Yu SS, AndersonGD, Burton EG, Cogburn JN, Gregory SA, Koboldt CM, Perkins WE, Seibert K, Veenhuizen AW, Zhang YY, Isakson PC.
J Med Chem (1997) 40 : 1347 -1365
PubMed 9135032 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 109 5.29 8.30

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL29204 1 8.30
CHEMBL26915 SC-560 1 8.15
CHEMBL30011 1 7.75
CHEMBL284914 1 7.26
CHEMBL280636 1 7.19
CHEMBL29257 1 7.10
CHEMBL29840 1 6.85
CHEMBL287447 1 6.77
CHEMBL28491 1 6.39
CHEMBL283086 1 6.24
CHEMBL282085 1 6.08
CHEMBL29766 1 6.08
CHEMBL29133 1 6.03
CHEMBL28662 1 6.01
CHEMBL282839 1 5.92
CHEMBL283178 1 5.92
CHEMBL282084 1 5.88
CHEMBL29697 1 5.76
CHEMBL283497 1 5.72
CHEMBL281694 1 5.72
CHEMBL29839 1 5.59
CHEMBL29472 1 5.54
CHEMBL28881 1 5.48
CHEMBL29899 1 5.42
CHEMBL283177 1 5.33
CHEMBL28487 1 5.29
CHEMBL433428 1 5.24
CHEMBL28913 1 5.20
CHEMBL29423 1 5.07
CHEMBL27975 1 5.06

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL29204 IC50 = 5.0 nM 8.30
CHEMBL26915 SC-560 IC50 = 7.0 nM 8.15
CHEMBL30011 IC50 = 18.0 nM 7.75
CHEMBL284914 IC50 = 55.0 nM 7.26
CHEMBL280636 IC50 = 65.0 nM 7.19
CHEMBL29257 IC50 = 80.0 nM 7.10
CHEMBL29840 IC50 = 140.0 nM 6.85
CHEMBL287447 IC50 = 170.0 nM 6.77
CHEMBL28491 IC50 = 410.0 nM 6.39
CHEMBL283086 IC50 = 580.0 nM 6.24
CHEMBL29766 IC50 = 830.0 nM 6.08
CHEMBL282085 IC50 = 830.0 nM 6.08
CHEMBL29133 IC50 = 930.0 nM 6.03
CHEMBL28662 IC50 = 970.0 nM 6.01
CHEMBL282839 IC50 = 1210.0 nM 5.92
CHEMBL283178 IC50 = 1190.0 nM 5.92
CHEMBL282084 IC50 = 1320.0 nM 5.88
CHEMBL29697 IC50 = 1750.0 nM 5.76
CHEMBL281694 IC50 = 1920.0 nM 5.72
CHEMBL283497 IC50 = 1920.0 nM 5.72
CHEMBL29839 IC50 = 2580.0 nM 5.59
CHEMBL29472 IC50 = 2910.0 nM 5.54
CHEMBL28881 IC50 = 3290.0 nM 5.48
CHEMBL29899 IC50 = 3800.0 nM 5.42
CHEMBL283177 IC50 = 4690.0 nM 5.33
CHEMBL28487 IC50 = 5100.0 nM 5.29
CHEMBL433428 IC50 = 5700.0 nM 5.24
CHEMBL28913 IC50 = 6330.0 nM 5.20
CHEMBL29423 IC50 = 8490.0 nM 5.07
CHEMBL27975 IC50 = 8710.0 nM 5.06
CHEMBL287170 IC50 = 8800.0 nM 5.06
CHEMBL29424 IC50 = 8980.0 nM 5.05
CHEMBL280601 IC50 = 12200.0 nM 4.91
CHEMBL281975 IC50 = 12500.0 nM 4.90
CHEMBL29469 IC50 = 12900.0 nM 4.89
CHEMBL29439 IC50 = 13800.0 nM 4.86
CHEMBL29500 IC50 = 15200.0 nM 4.82
CHEMBL118 CELECOXIB IC50 = 15000.0 nM 4.82
CHEMBL29887 IC50 = 15400.0 nM 4.81
CHEMBL29717 IC50 = 17400.0 nM 4.76
CHEMBL282093 IC50 = 17800.0 nM 4.75
CHEMBL29923 IC50 = 18100.0 nM 4.74
CHEMBL28527 MAVACOXIB IC50 = 25500.0 nM 4.59
CHEMBL286953 IC50 = 27600.0 nM 4.56
CHEMBL283388 IC50 = 28200.0 nM 4.55
CHEMBL28801 IC50 = 29000.0 nM 4.54
CHEMBL29083 IC50 = 29800.0 nM 4.53
CHEMBL418574 IC50 = 29500.0 nM 4.53
CHEMBL281978 IC50 = 31200.0 nM 4.51
CHEMBL282301 IC50 = 31000.0 nM 4.51