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Assay Detail

CHEMBL873459

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Binding
Inhibitory activity against prostaglandin G/H synthase 1 (COX-1)
ChEMBL ↗
50
Total Activities
50
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Ovis aries
Confidence 9 — Direct single protein target
Curated By Intermediate

Target

Prostaglandin G/H synthase 1 (CHEMBL2949) ↗
Type SINGLE PROTEIN
Organism Ovis aries

Publication

Inhibitory mode of 1,5-diarylpyrazole derivatives against cyclooxygenase-2 and cyclooxygenase-1: molecular docking and 3D QSAR analyses.
Liu H, Huang X, Shen J, Luo X, Li M, Xiong B, Chen G, Shen J, Yang Y, Jiang H, Chen K.
J Med Chem (2002) 45 : 4816 -4827
PubMed 12383007 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 50 4.99 7.19

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL280636 — — 1 7.19
CHEMBL29840 — — 1 6.85
CHEMBL28491 — — 1 6.39
CHEMBL29133 — — 1 6.03
CHEMBL283178 — — 1 5.92
CHEMBL282839 — — 1 5.92
CHEMBL29839 — — 1 5.59
CHEMBL29899 — — 1 5.42
CHEMBL283177 — — 1 5.33
CHEMBL28487 — — 1 5.29
CHEMBL28913 — — 1 5.20
CHEMBL287170 — — 1 5.06
CHEMBL29424 — — 1 5.05
CHEMBL29439 — — 1 4.86
CHEMBL118 CELECOXIB 4.0 1 4.82
CHEMBL29887 — — 1 4.81
CHEMBL29717 — — 1 4.76
CHEMBL282093 — — 1 4.75
CHEMBL29923 — — 1 4.74
CHEMBL28527 MAVACOXIB 2.0 1 4.59
CHEMBL286953 — — 1 4.56
CHEMBL29083 — — 1 4.53
CHEMBL418574 — — 1 4.53
CHEMBL29533 — — 1 4.50
CHEMBL29445 — — 1 4.47
CHEMBL28599 — — 1 4.47
CHEMBL281001 — — 1 4.28
CHEMBL29920 — — 1 4.26
CHEMBL29456 — — 1 4.20
CHEMBL30084 — — 1 4.11

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL280636 — IC50 = 64.57 nM 7.19
CHEMBL29840 — IC50 = 141.25 nM 6.85
CHEMBL28491 — IC50 = 407.38 nM 6.39
CHEMBL29133 — IC50 = 933.25 nM 6.03
CHEMBL283178 — IC50 = 1202.26 nM 5.92
CHEMBL282839 — IC50 = 1202.26 nM 5.92
CHEMBL29839 — IC50 = 2570.4 nM 5.59
CHEMBL29899 — IC50 = 3801.89 nM 5.42
CHEMBL283177 — IC50 = 4677.35 nM 5.33
CHEMBL28487 — IC50 = 5128.61 nM 5.29
CHEMBL28913 — IC50 = 6309.57 nM 5.20
CHEMBL287170 — IC50 = 8709.64 nM 5.06
CHEMBL29424 — IC50 = 8912.51 nM 5.05
CHEMBL29439 — IC50 = 13803.84 nM 4.86
CHEMBL118 CELECOXIB IC50 = 15135.61 nM 4.82
CHEMBL29887 — IC50 = 15488.17 nM 4.81
CHEMBL29717 — IC50 = 17378.01 nM 4.76
CHEMBL282093 — IC50 = 17782.79 nM 4.75
CHEMBL29923 — IC50 = 18197.01 nM 4.74
CHEMBL28527 MAVACOXIB IC50 = 25703.96 nM 4.59
CHEMBL286953 — IC50 = 27542.29 nM 4.56
CHEMBL29083 — IC50 = 29512.09 nM 4.53
CHEMBL418574 — IC50 = 29512.09 nM 4.53
CHEMBL29533 — IC50 = 31622.78 nM 4.50
CHEMBL28599 — IC50 = 33884.42 nM 4.47
CHEMBL29445 — IC50 = 33884.42 nM 4.47
CHEMBL281001 — IC50 = 52480.75 nM 4.28
CHEMBL29920 — IC50 = 54954.09 nM 4.26
CHEMBL29456 — IC50 = 63095.73 nM 4.20
CHEMBL30084 — IC50 = 77624.71 nM 4.11
CHEMBL287646 — IC50 = 77624.71 nM 4.11
CHEMBL283038 — IC50 = 81283.05 nM 4.09
CHEMBL29075 — IC50 = 93325.43 nM 4.03
CHEMBL29842 — IC50 > 100000.0 nM -
CHEMBL743 CARBOXYLIC ACID METABOLITE OF CELECOXIB IC50 > 251188.64 nM -
CHEMBL281504 — IC50 > 100000.0 nM -
CHEMBL29847 — IC50 > 100000.0 nM -
CHEMBL29492 — IC50 > 100000.0 nM -
CHEMBL440798 — IC50 > 100000.0 nM -
CHEMBL29942 — IC50 > 100000.0 nM -
CHEMBL28664 — IC50 > 100000.0 nM -
CHEMBL283425 — IC50 = 208929.61 nM -
CHEMBL745 PRIMARY ALCOHOL METABOLITE OF CELECOXIB IC50 > 1000000.0 nM -
CHEMBL282360 — IC50 > 100000.0 nM -
CHEMBL280573 — IC50 > 100000.0 nM -
CHEMBL28528 — IC50 > 100000.0 nM -
CHEMBL27733 — IC50 > 100000.0 nM -
CHEMBL30091 — IC50 > 100000.0 nM -
CHEMBL29136 — IC50 > 100000.0 nM -
CHEMBL406140 — IC50 > 100000.0 nM -