Click here for a description of the charts and data table
Please tell us if you are using this feature and what you think!
ChEMBL ligand: CHEMBL416146 (Arcoxia, Etoricoxib, L-791456, MK-0663) |
---|
There should be some charts here, you may need to enable JavaScript!
|
There should be some charts here, you may need to enable JavaScript!
|
There should be some charts here, you may need to enable JavaScript!
|
DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
---|---|---|---|---|---|---|---|---|
COX-1 /Cyclooxygenase-1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL221] [GtoPdb: 1375] [UniProtKB: P23219] | ||||||||
ChEMBL | Inhibition of human cyclooxygenase-1 expressed in COS cells | B | 4 | pIC50 | >100000 | nM | IC50 | Bioorg Med Chem Lett (2004) 14: 5445-5448 [PMID:15454242] |
ChEMBL | In vitro inhibition of Prostaglandin G/H synthase 1 in human whole blood assay | B | 4 | pIC50 | >100000 | nM | IC50 | Bioorg Med Chem Lett (2001) 11: 1059-1062 [PMID:11327589] |
ChEMBL | Inhibition of human COX1 expressed in african green monkey COS cells assessed as inhibition of arachidonic acid-stimulated PGE2 treated 1 hr before arachidonic acid challenge by enzyme immunoassay | B | 4 | pIC50 | >100000 | nM | IC50 | Bioorg Med Chem Lett (2009) 19: 4504-4508 [PMID:19520573] |
ChEMBL | Inhibition of COX1 in human whole blood assessed as inhibition of lipopolysaccharide-induced TxB2 production after 30 min by enzyme immunoassay | B | 4 | pIC50 | >100000 | nM | IC50 | Bioorg Med Chem Lett (2009) 19: 4504-4508 [PMID:19520573] |
ChEMBL | Inhibition concentration against cyclooxygenase-1 (COX-1) in human whole blood | B | 4.01 | pIC50 | 98800 | nM | IC50 | J Med Chem (2004) 47: 3874-3886 [PMID:15239665] |
ChEMBL | Inhibition of COX1 in human whole blood assessed as reduction in calcium ionophore-stimulated TXB2 production incubated for 1 hr by ELISA | B | 4.03 | pIC50 | 93800 | nM | IC50 | J Med Chem (2021) 64: 11570-11596 [PMID:34279934] |
ChEMBL | Inhibition of Prostaglandin G/H synthase 1 was measured by the inhibition of PGE-2 produced by microsomes from U937 cells at subsaturating arachidonic acid conc. | B | 4.92 | pIC50 | 12000 | nM | IC50 | Bioorg Med Chem Lett (1998) 8: 2777-2782 [PMID:9873621] |
Cyclooxygenase-1 in Sheep (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2949] [UniProtKB: P05979] | ||||||||
ChEMBL | Inhibition of ovine COX1 using arachidonic acid as substrate preincubated for 10 mins followed by substrate addition and measured after 2 mins by ELISA | B | 4.52 | pIC50 | >30000 | nM | IC50 | Medchemcomm (2019) 10: 421-430 [PMID:30996860] |
COX-2 /Cyclooxygenase-2 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL230] [GtoPdb: 1376] [UniProtKB: P35354] | ||||||||
ChEMBL | Inhibition of human recombinant COX-2 using arachidonic acid as substrate preincubated for 60 mins followed by substrate addition for 2 secs by ADPH based fluorometric analysis | B | 7.16 | pKi | 69 | nM | Ki | J Med Chem (2021) 64: 11570-11596 [PMID:34279934] |
ChEMBL | In vitro inhibitory concentration against Prostaglandin G/H synthase 2 (COX-2) in human whole blood | B | 5.7 | pIC50 | 2000 | nM | IC50 | J Med Chem (2005) 48: 3930-3934 [PMID:15916445] |
ChEMBL | Inhibition of human recombinant COX2 using arachidonic acid as substrate preincubated for 5 mins followed by substrate addition and measured after 2 mins by ADPH probe-based fluorescence assay | B | 5.96 | pIC50 | 1100 | nM | IC50 | Eur J Med Chem (2018) 151: 520-532 [PMID:29655084] |
ChEMBL | Inhibition of Prostaglandin G/H synthase 2 was measured by the inhibition of PGE-2 produced by lipopolysaccharide-challenged HWB | B | 5.96 | pIC50 | 1100 | nM | IC50 | Bioorg Med Chem Lett (1998) 8: 2777-2782 [PMID:9873621] |
ChEMBL | In vitro inhibition of Prostaglandin G/H synthase 2 in human whole blood assay | B | 5.96 | pIC50 | 1100 | nM | IC50 | Bioorg Med Chem Lett (2001) 11: 1059-1062 [PMID:11327589] |
GtoPdb | - | - | 6 | pIC50 | 1100 | nM | IC50 | J Pharmacol Exp Ther (2001) 296: 558-66 [PMID:11160644] |
ChEMBL | Inhibition concentration against cyclooxygenase-2 (COX-2) in human whole blood | B | 6.09 | pIC50 | 810 | nM | IC50 | J Med Chem (2004) 47: 3874-3886 [PMID:15239665] |
ChEMBL | Inhibition of COX2 in human whole blood | B | 6.09 | pIC50 | 810 | nM | IC50 | Bioorg Med Chem Lett (2006) 16: 3209-3212 [PMID:16616494] |
ChEMBL | Inhibition of COX2 in human whole blood | B | 6.09 | pIC50 | 810 | nM | IC50 | Bioorg Med Chem Lett (2006) 16: 3605-3608 [PMID:16647258] |
ChEMBL | Inhibition of COX2 in human whole blood assessed as reduction in LPS stimulated PGE2 production incubated for 1 hr by ELISA | B | 6.21 | pIC50 | 611 | nM | IC50 | J Med Chem (2021) 64: 11570-11596 [PMID:34279934] |
ChEMBL | Inhibition of COX2 (unknown origin) expressed in HEK293 TRex cells assessed as reduction in PGE2 production using arachidonic acid as substrate preincubated for 60 mins followed by substrate addition for 1 hr in presence of 10% FBS by RapidFire High-Throughput Mass Spectrometry | B | 6.25 | pIC50 | 560 | nM | IC50 | J Med Chem (2021) 64: 11570-11596 [PMID:34279934] |
ChEMBL | Inhibition of COX2 in human whole blood assessed as inhibition of lipopolysaccharide-stimulated PGE2 production after 24 hrs by enzyme immunoassay | B | 6.26 | pIC50 | 554 | nM | IC50 | Bioorg Med Chem Lett (2009) 19: 4504-4508 [PMID:19520573] |
ChEMBL | Inhibition of human recombinant COX-2 assessed as reduction in peroxidase activity using arachidonic acid as substrate preincubated for 60 mins followed by substrate addition for 2 secs by ADPH based fluorometric analysis | B | 6.37 | pIC50 | 430 | nM | IC50 | J Med Chem (2021) 64: 11570-11596 [PMID:34279934] |
ChEMBL | Inhibition of human cyclooxygenase-2 expressed in COS cells | B | 6.46 | pIC50 | 347 | nM | IC50 | Bioorg Med Chem Lett (2004) 14: 5445-5448 [PMID:15454242] |
ChEMBL | Inhibition of human COX2 expressed in african green monkey COS cells assessed as inhibition of arachidonic acid-stimulated PGE2 production treated 1 hr before arachidonic acid challenge by enzyme immunoassay | B | 6.46 | pIC50 | 347 | nM | IC50 | Bioorg Med Chem Lett (2009) 19: 4504-4508 [PMID:19520573] |
ChEMBL | Inhibition of human COX-2 transfected in CHO cells using arachidonic acid as substrate | B | 7.09 | pIC50 | 81 | nM | IC50 | Eur J Med Chem (2019) 162: 1-17 [PMID:30396033] |
ChEMBL | In vitro inhibition of PGE-2 produced by arachidonic acid-stimulated CHO cells stably expressing human Prostaglandin G/H synthase 2 | B | 7.09 | pIC50 | 81 | nM | IC50 | Bioorg Med Chem Lett (1998) 8: 2777-2782 [PMID:9873621] |
Cyclooxygenase-2 in Sheep (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4102] [UniProtKB: P79208] | ||||||||
ChEMBL | Inhibition of ovine COX2 using arachidonic acid as substrate preincubated for 10 mins followed by substrate addition and measured after 2 mins by ELISA | B | 6.64 | pIC50 | 230 | nM | IC50 | Medchemcomm (2019) 10: 421-430 [PMID:30996860] |
mitogen-activated protein kinase 14/MAP kinase p38 alpha in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL260] [GtoPdb: 1499] [UniProtKB: Q16539] | ||||||||
ChEMBL | Inhibitory concentration against p38 alpha MAP kinase calculated by CoMFA model; FlexX score = -18.6kcal/mol | B | 6.28 | pIC50 | 530 | nM | IC50 | Bioorg Med Chem Lett (2005) 15: 3506-3509 [PMID:15990304] |
ChEMBL data shown on this page come from version 32:
Mendez D, Gaulton A, Bento AP, Chambers J, De Veij M, Félix E, Magariños MP, Mosquera JF, Mutowo P, Nowotka M, Gordillo-Marañón M, Hunter F, Junco L, Mugumbate G, Rodriguez-Lopez M, Atkinson F, Bosc N, Radoux CJ, Segura-Cabrera A, Hersey A, Leach AR. (2019) 'ChEMBL: towards direct deposition of bioassay data' Nucleic Acids Res., 47(D1). DOI: 10.1093/nar/gky1075. [EPMCID:30398643]
Davies M, Nowotka M, Papadatos G, Dedman N, Gaulton A, Atkinson F, Bellis L, Overington JP. (2015) 'ChEMBL web services: streamlining access to drug discovery data and utilities.' Nucleic Acids Res., 43(W1). DOI: 10.1093/nar/gkv352. [EPMCID:25883136]