Found 117 hits of Enzyme Inhibition Constant Data Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM11639
(4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyraz...)Show SMILES Cc1ccc(cc1)-c1cc(nn1-c1ccc(cc1)S(N)(=O)=O)C(F)(F)F Show InChI InChI=1S/C17H14F3N3O2S/c1-11-2-4-12(5-3-11)15-10-16(17(18,19)20)22-23(15)13-6-8-14(9-7-13)26(21,24)25/h2-10H,1H3,(H2,21,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| DrugBank
PDB
Article
PubMed
| n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM11639
(4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyraz...)Show SMILES Cc1ccc(cc1)-c1cc(nn1-c1ccc(cc1)S(N)(=O)=O)C(F)(F)F Show InChI InChI=1S/C17H14F3N3O2S/c1-11-2-4-12(5-3-11)15-10-16(17(18,19)20)22-23(15)13-6-8-14(9-7-13)26(21,24)25/h2-10H,1H3,(H2,21,24,25) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PDB
Article
PubMed
| n/a | n/a | 120 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429262
(CHEMBL2334141)Show SMILES CCCCNC(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C24H29NO4/c1-5-6-15-25-24(26)14-13-22-19(16-21(28-3)17-23(22)29-4)10-7-18-8-11-20(27-2)12-9-18/h7-14,16-17H,5-6,15H2,1-4H3,(H,25,26)/b10-7+,14-13+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 280 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429284
(CHEMBL2333743)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NCCCCl)cc1 Show InChI InChI=1S/C23H26ClNO4/c1-27-19-9-6-17(7-10-19)5-8-18-15-20(28-2)16-22(29-3)21(18)11-12-23(26)25-14-4-13-24/h5-12,15-16H,4,13-14H2,1-3H3,(H,25,26)/b8-5+,12-11+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 390 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429285
(CHEMBL2333742)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NCCCl)cc1 Show InChI InChI=1S/C22H24ClNO4/c1-26-18-8-5-16(6-9-18)4-7-17-14-19(27-2)15-21(28-3)20(17)10-11-22(25)24-13-12-23/h4-11,14-15H,12-13H2,1-3H3,(H,24,25)/b7-4+,11-10+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 450 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429271
(CHEMBL2333735)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCC(Cl)CC2)cc1 Show InChI InChI=1S/C25H28ClNO4/c1-29-21-8-5-18(6-9-21)4-7-19-16-22(30-2)17-24(31-3)23(19)10-11-25(28)27-14-12-20(26)13-15-27/h4-11,16-17,20H,12-15H2,1-3H3/b7-4+,11-10+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 460 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429273
(CHEMBL2333733)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CC(C)CC(C)C2)cc1 Show InChI InChI=1S/C27H33NO4/c1-19-14-20(2)18-28(17-19)27(29)13-12-25-22(15-24(31-4)16-26(25)32-5)9-6-21-7-10-23(30-3)11-8-21/h6-13,15-16,19-20H,14,17-18H2,1-5H3/b9-6+,13-12+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 580 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429282
(CHEMBL2333745)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NC(C)C)cc1 Show InChI InChI=1S/C23H27NO4/c1-16(2)24-23(25)13-12-21-18(14-20(27-4)15-22(21)28-5)9-6-17-7-10-19(26-3)11-8-17/h6-16H,1-5H3,(H,24,25)/b9-6+,13-12+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 720 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429268
(CHEMBL2333738)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCOCC2)cc1 Show InChI InChI=1S/C24H27NO5/c1-27-20-8-5-18(6-9-20)4-7-19-16-21(28-2)17-23(29-3)22(19)10-11-24(26)25-12-14-30-15-13-25/h4-11,16-17H,12-15H2,1-3H3/b7-4+,11-10+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 850 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429262
(CHEMBL2334141)Show SMILES CCCCNC(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C24H29NO4/c1-5-6-15-25-24(26)14-13-22-19(16-21(28-3)17-23(22)29-4)10-7-18-8-11-20(27-2)12-9-18/h7-14,16-17H,5-6,15H2,1-4H3,(H,25,26)/b10-7+,14-13+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.02E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429284
(CHEMBL2333743)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NCCCCl)cc1 Show InChI InChI=1S/C23H26ClNO4/c1-27-19-9-6-17(7-10-19)5-8-18-15-20(28-2)16-22(29-3)21(18)11-12-23(26)25-14-4-13-24/h5-12,15-16H,4,13-14H2,1-3H3,(H,25,26)/b8-5+,12-11+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.27E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429285
(CHEMBL2333742)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NCCCl)cc1 Show InChI InChI=1S/C22H24ClNO4/c1-26-18-8-5-16(6-9-18)4-7-17-14-19(27-2)15-21(28-3)20(17)10-11-22(25)24-13-12-23/h4-11,14-15H,12-13H2,1-3H3,(H,24,25)/b7-4+,11-10+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.36E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429271
(CHEMBL2333735)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCC(Cl)CC2)cc1 Show InChI InChI=1S/C25H28ClNO4/c1-29-21-8-5-18(6-9-21)4-7-19-16-22(30-2)17-24(31-3)23(19)10-11-25(28)27-14-12-20(26)13-15-27/h4-11,16-17,20H,12-15H2,1-3H3/b7-4+,11-10+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.45E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429269
(CHEMBL2333737)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCN(C)CC2)cc1 Show InChI InChI=1S/C25H30N2O4/c1-26-13-15-27(16-14-26)25(28)12-11-23-20(17-22(30-3)18-24(23)31-4)8-5-19-6-9-21(29-2)10-7-19/h5-12,17-18H,13-16H2,1-4H3/b8-5+,12-11+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.62E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429268
(CHEMBL2333738)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCOCC2)cc1 Show InChI InChI=1S/C24H27NO5/c1-27-20-8-5-18(6-9-20)4-7-19-16-21(28-2)17-23(29-3)22(19)10-11-24(26)25-12-14-30-15-13-25/h4-11,16-17H,12-15H2,1-3H3/b7-4+,11-10+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.88E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429277
(CHEMBL2333750)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NC2CCCCC2)cc1 Show InChI InChI=1S/C26H31NO4/c1-29-22-13-10-19(11-14-22)9-12-20-17-23(30-2)18-25(31-3)24(20)15-16-26(28)27-21-7-5-4-6-8-21/h9-18,21H,4-8H2,1-3H3,(H,27,28)/b12-9+,16-15+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.98E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429273
(CHEMBL2333733)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CC(C)CC(C)C2)cc1 Show InChI InChI=1S/C27H33NO4/c1-19-14-20(2)18-28(17-19)27(29)13-12-25-22(15-24(31-4)16-26(25)32-5)9-6-21-7-10-23(30-3)11-8-21/h6-13,15-16,19-20H,14,17-18H2,1-5H3/b9-6+,13-12+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.98E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429282
(CHEMBL2333745)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NC(C)C)cc1 Show InChI InChI=1S/C23H27NO4/c1-16(2)24-23(25)13-12-21-18(14-20(27-4)15-22(21)28-5)9-6-17-7-10-19(26-3)11-8-17/h6-16H,1-5H3,(H,24,25)/b9-6+,13-12+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.01E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429263
(CHEMBL2334140)Show SMILES CCCNC(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C23H27NO4/c1-5-14-24-23(25)13-12-21-18(15-20(27-3)16-22(21)28-4)9-6-17-7-10-19(26-2)11-8-17/h6-13,15-16H,5,14H2,1-4H3,(H,24,25)/b9-6+,13-12+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.08E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429279
(CHEMBL2333748)Show SMILES CCC(C)NC(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C24H29NO4/c1-6-17(2)25-24(26)14-13-22-19(15-21(28-4)16-23(22)29-5)10-7-18-8-11-20(27-3)12-9-18/h7-17H,6H2,1-5H3,(H,25,26)/b10-7+,14-13+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.09E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429296
(CHEMBL2333753)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)Nc2cc(OC)c(OC)c(OC)c2)cc1 Show InChI InChI=1S/C29H31NO7/c1-32-22-11-8-19(9-12-22)7-10-20-15-23(33-2)18-25(34-3)24(20)13-14-28(31)30-21-16-26(35-4)29(37-6)27(17-21)36-5/h7-18H,1-6H3,(H,30,31)/b10-7+,14-13+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429294
(CHEMBL2333755)Show SMILES CCN(CC)C(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C24H29NO4/c1-6-25(7-2)24(26)15-14-22-19(16-21(28-4)17-23(22)29-5)11-8-18-9-12-20(27-3)13-10-18/h8-17H,6-7H2,1-5H3/b11-8+,15-14+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.15E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429276
(CHEMBL2334136)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCCCC2C)cc1 Show InChI InChI=1S/C26H31NO4/c1-19-7-5-6-16-27(19)26(28)15-14-24-21(17-23(30-3)18-25(24)31-4)11-8-20-9-12-22(29-2)13-10-20/h8-15,17-19H,5-7,16H2,1-4H3/b11-8+,15-14+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.44E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429291
(CHEMBL2334131)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N(CC(C)C)CC(C)C)cc1 Show InChI InChI=1S/C28H37NO4/c1-20(2)18-29(19-21(3)4)28(30)15-14-26-23(16-25(32-6)17-27(26)33-7)11-8-22-9-12-24(31-5)13-10-22/h8-17,20-21H,18-19H2,1-7H3/b11-8+,15-14+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.56E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429265
(CHEMBL2333741)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(O)=O)cc1 Show InChI InChI=1S/C20H20O5/c1-23-16-8-5-14(6-9-16)4-7-15-12-17(24-2)13-19(25-3)18(15)10-11-20(21)22/h4-13H,1-3H3,(H,21,22)/b7-4+,11-10+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.01E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429289
(CHEMBL2334133)Show SMILES CCCCCCN(CCCCCC)C(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C32H45NO4/c1-6-8-10-12-22-33(23-13-11-9-7-2)32(34)21-20-30-27(24-29(36-4)25-31(30)37-5)17-14-26-15-18-28(35-3)19-16-26/h14-21,24-25H,6-13,22-23H2,1-5H3/b17-14+,21-20+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429298
(CHEMBL2333751)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NCc2ccco2)cc1 Show InChI InChI=1S/C25H25NO5/c1-28-20-10-7-18(8-11-20)6-9-19-15-22(29-2)16-24(30-3)23(19)12-13-25(27)26-17-21-5-4-14-31-21/h4-16H,17H2,1-3H3,(H,26,27)/b9-6+,13-12+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.15E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429275
(CHEMBL2334137)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCCC(C)C2)cc1 Show InChI InChI=1S/C26H31NO4/c1-19-6-5-15-27(18-19)26(28)14-13-24-21(16-23(30-3)17-25(24)31-4)10-7-20-8-11-22(29-2)12-9-20/h7-14,16-17,19H,5-6,15,18H2,1-4H3/b10-7+,14-13+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.16E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429267
(CHEMBL2333739)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCSCC2)cc1 Show InChI InChI=1S/C24H27NO4S/c1-27-20-8-5-18(6-9-20)4-7-19-16-21(28-2)17-23(29-3)22(19)10-11-24(26)25-12-14-30-15-13-25/h4-11,16-17H,12-15H2,1-3H3/b7-4+,11-10+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.18E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429288
(CHEMBL2334134)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N(CC=C)CC=C)cc1 Show InChI InChI=1S/C26H29NO4/c1-6-16-27(17-7-2)26(28)15-14-24-21(18-23(30-4)19-25(24)31-5)11-8-20-9-12-22(29-3)13-10-20/h6-15,18-19H,1-2,16-17H2,3-5H3/b11-8+,15-14+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.28E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429270
(CHEMBL2333736)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCC(CC2)c2ccccc2)cc1 Show InChI InChI=1S/C31H33NO4/c1-34-27-13-10-23(11-14-27)9-12-26-21-28(35-2)22-30(36-3)29(26)15-16-31(33)32-19-17-25(18-20-32)24-7-5-4-6-8-24/h4-16,21-22,25H,17-20H2,1-3H3/b12-9+,16-15+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.55E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429297
(CHEMBL2333752)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NCCCN2CCOCC2)cc1 Show InChI InChI=1S/C27H34N2O5/c1-31-23-9-6-21(7-10-23)5-8-22-19-24(32-2)20-26(33-3)25(22)11-12-27(30)28-13-4-14-29-15-17-34-18-16-29/h5-12,19-20H,4,13-18H2,1-3H3,(H,28,30)/b8-5+,12-11+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.68E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429266
(CHEMBL2333740)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCCC2)cc1 Show InChI InChI=1S/C24H27NO4/c1-27-20-10-7-18(8-11-20)6-9-19-16-21(28-2)17-23(29-3)22(19)12-13-24(26)25-14-4-5-15-25/h6-13,16-17H,4-5,14-15H2,1-3H3/b9-6+,13-12+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.76E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429293
(CHEMBL2334129)Show SMILES CCCN(CCC)C(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C26H33NO4/c1-6-16-27(17-7-2)26(28)15-14-24-21(18-23(30-4)19-25(24)31-5)11-8-20-9-12-22(29-3)13-10-20/h8-15,18-19H,6-7,16-17H2,1-5H3/b11-8+,15-14+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.88E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429292
(CHEMBL2334130)Show SMILES CCCCN(CCCC)C(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C28H37NO4/c1-6-8-18-29(19-9-7-2)28(30)17-16-26-23(20-25(32-4)21-27(26)33-5)13-10-22-11-14-24(31-3)15-12-22/h10-17,20-21H,6-9,18-19H2,1-5H3/b13-10+,17-16+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.12E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429295
(CHEMBL2333754)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N(C)C)cc1 Show InChI InChI=1S/C22H25NO4/c1-23(2)22(24)13-12-20-17(14-19(26-4)15-21(20)27-5)9-6-16-7-10-18(25-3)11-8-16/h6-15H,1-5H3/b9-6+,13-12+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.36E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429279
(CHEMBL2333748)Show SMILES CCC(C)NC(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C24H29NO4/c1-6-17(2)25-24(26)14-13-22-19(15-21(28-4)16-23(22)29-5)10-7-18-8-11-20(27-3)12-9-18/h7-17H,6H2,1-5H3,(H,25,26)/b10-7+,14-13+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.56E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429294
(CHEMBL2333755)Show SMILES CCN(CC)C(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C24H29NO4/c1-6-25(7-2)24(26)15-14-22-19(16-21(28-4)17-23(22)29-5)11-8-18-9-12-20(27-3)13-10-18/h8-17H,6-7H2,1-5H3/b11-8+,15-14+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.67E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429261
(CHEMBL2334142)Show SMILES CCCCCCNC(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C26H33NO4/c1-5-6-7-8-17-27-26(28)16-15-24-21(18-23(30-3)19-25(24)31-4)12-9-20-10-13-22(29-2)14-11-20/h9-16,18-19H,5-8,17H2,1-4H3,(H,27,28)/b12-9+,16-15+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.01E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429283
(CHEMBL2333744)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NCC#C)cc1 Show InChI InChI=1S/C23H23NO4/c1-5-14-24-23(25)13-12-21-18(15-20(27-3)16-22(21)28-4)9-6-17-7-10-19(26-2)11-8-17/h1,6-13,15-16H,14H2,2-4H3,(H,24,25)/b9-6+,13-12+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.08E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429277
(CHEMBL2333750)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NC2CCCCC2)cc1 Show InChI InChI=1S/C26H31NO4/c1-29-22-13-10-19(11-14-22)9-12-20-17-23(30-2)18-25(31-3)24(20)15-16-26(28)27-21-7-5-4-6-8-21/h9-18,21H,4-8H2,1-3H3,(H,27,28)/b12-9+,16-15+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.09E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429281
(CHEMBL2333746)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NC(C)(C)C)cc1 Show InChI InChI=1S/C24H29NO4/c1-24(2,3)25-23(26)14-13-21-18(15-20(28-5)16-22(21)29-6)10-7-17-8-11-19(27-4)12-9-17/h7-16H,1-6H3,(H,25,26)/b10-7+,14-13+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.29E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429269
(CHEMBL2333737)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCN(C)CC2)cc1 Show InChI InChI=1S/C25H30N2O4/c1-26-13-15-27(16-14-26)25(28)12-11-23-20(17-22(30-3)18-24(23)31-4)8-5-19-6-9-21(29-2)10-7-19/h5-12,17-18H,13-16H2,1-4H3/b8-5+,12-11+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.78E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429280
(CHEMBL2333747)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NCC(C)C)cc1 Show InChI InChI=1S/C24H29NO4/c1-17(2)16-25-24(26)13-12-22-19(14-21(28-4)15-23(22)29-5)9-6-18-7-10-20(27-3)11-8-18/h6-15,17H,16H2,1-5H3,(H,25,26)/b9-6+,13-12+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.12E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429272
(CHEMBL2333734)Show SMILES CCC1CCCCN1C(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C27H33NO4/c1-5-22-8-6-7-17-28(22)27(29)16-15-25-21(18-24(31-3)19-26(25)32-4)12-9-20-10-13-23(30-2)14-11-20/h9-16,18-19,22H,5-8,17H2,1-4H3/b12-9+,16-15+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.27E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429296
(CHEMBL2333753)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)Nc2cc(OC)c(OC)c(OC)c2)cc1 Show InChI InChI=1S/C29H31NO7/c1-32-22-11-8-19(9-12-22)7-10-20-15-23(33-2)18-25(34-3)24(20)13-14-28(31)30-21-16-26(35-4)29(37-6)27(17-21)36-5/h7-18H,1-6H3,(H,30,31)/b10-7+,14-13+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.66E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429276
(CHEMBL2334136)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCCCC2C)cc1 Show InChI InChI=1S/C26H31NO4/c1-19-7-5-6-16-27(19)26(28)15-14-24-21(17-23(30-3)18-25(24)31-4)11-8-20-9-12-22(29-2)13-10-20/h8-15,17-19H,5-7,16H2,1-4H3/b11-8+,15-14+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.69E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429263
(CHEMBL2334140)Show SMILES CCCNC(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C23H27NO4/c1-5-14-24-23(25)13-12-21-18(15-20(27-3)16-22(21)28-4)9-6-17-7-10-19(26-2)11-8-17/h6-13,15-16H,5,14H2,1-4H3,(H,24,25)/b9-6+,13-12+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.75E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429291
(CHEMBL2334131)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N(CC(C)C)CC(C)C)cc1 Show InChI InChI=1S/C28H37NO4/c1-20(2)18-29(19-21(3)4)28(30)15-14-26-23(16-25(32-6)17-27(26)33-7)11-8-22-9-12-24(31-5)13-10-22/h8-17,20-21H,18-19H2,1-7H3/b11-8+,15-14+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.84E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429265
(CHEMBL2333741)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(O)=O)cc1 Show InChI InChI=1S/C20H20O5/c1-23-16-8-5-14(6-9-16)4-7-15-12-17(24-2)13-19(25-3)18(15)10-11-20(21)22/h4-13H,1-3H3,(H,21,22)/b7-4+,11-10+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 6.89E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429278
(CHEMBL2333749)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NC2CC2)cc1 Show InChI InChI=1S/C23H25NO4/c1-26-19-10-5-16(6-11-19)4-7-17-14-20(27-2)15-22(28-3)21(17)12-13-23(25)24-18-8-9-18/h4-7,10-15,18H,8-9H2,1-3H3,(H,24,25)/b7-4+,13-12+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.05E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429264
(CHEMBL2334139)Show SMILES CCNC(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C22H25NO4/c1-5-23-22(24)13-12-20-17(14-19(26-3)15-21(20)27-4)9-6-16-7-10-18(25-2)11-8-16/h6-15H,5H2,1-4H3,(H,23,24)/b9-6+,13-12+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.06E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429275
(CHEMBL2334137)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCCC(C)C2)cc1 Show InChI InChI=1S/C26H31NO4/c1-19-6-5-15-27(18-19)26(28)14-13-24-21(16-23(30-3)17-25(24)31-4)10-7-20-8-11-22(29-2)12-9-20/h7-14,16-17,19H,5-6,15,18H2,1-4H3/b10-7+,14-13+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.09E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429290
(CHEMBL2334132)Show SMILES CCCCCN(CCCCC)C(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C30H41NO4/c1-6-8-10-20-31(21-11-9-7-2)30(32)19-18-28-25(22-27(34-4)23-29(28)35-5)15-12-24-13-16-26(33-3)17-14-24/h12-19,22-23H,6-11,20-21H2,1-5H3/b15-12+,19-18+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.19E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429288
(CHEMBL2334134)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N(CC=C)CC=C)cc1 Show InChI InChI=1S/C26H29NO4/c1-6-16-27(17-7-2)26(28)15-14-24-21(18-23(30-4)19-25(24)31-5)11-8-20-9-12-22(29-3)13-10-20/h6-15,18-19H,1-2,16-17H2,3-5H3/b11-8+,15-14+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8.01E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429267
(CHEMBL2333739)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCSCC2)cc1 Show InChI InChI=1S/C24H27NO4S/c1-27-20-8-5-18(6-9-20)4-7-19-16-21(28-2)17-23(29-3)22(19)10-11-24(26)25-12-14-30-15-13-25/h4-11,16-17H,12-15H2,1-3H3/b7-4+,11-10+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8.01E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429293
(CHEMBL2334129)Show SMILES CCCN(CCC)C(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C26H33NO4/c1-6-16-27(17-7-2)26(28)15-14-24-21(18-23(30-4)19-25(24)31-5)11-8-20-9-12-22(29-3)13-10-20/h8-15,18-19H,6-7,16-17H2,1-5H3/b11-8+,15-14+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8.06E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429274
(CHEMBL2334138)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCC(C)CC2)cc1 Show InChI InChI=1S/C26H31NO4/c1-19-13-15-27(16-14-19)26(28)12-11-24-21(17-23(30-3)18-25(24)31-4)8-5-20-6-9-22(29-2)10-7-20/h5-12,17-19H,13-16H2,1-4H3/b8-5+,12-11+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8.09E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429270
(CHEMBL2333736)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCC(CC2)c2ccccc2)cc1 Show InChI InChI=1S/C31H33NO4/c1-34-27-13-10-23(11-14-27)9-12-26-21-28(35-2)22-30(36-3)29(26)15-16-31(33)32-19-17-25(18-20-32)24-7-5-4-6-8-24/h4-16,21-22,25H,17-20H2,1-3H3/b12-9+,16-15+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8.57E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429266
(CHEMBL2333740)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCCC2)cc1 Show InChI InChI=1S/C24H27NO4/c1-27-20-10-7-18(8-11-20)6-9-19-16-21(28-2)17-23(29-3)22(19)12-13-24(26)25-14-4-5-15-25/h6-13,16-17H,4-5,14-15H2,1-3H3/b9-6+,13-12+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8.87E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429297
(CHEMBL2333752)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NCCCN2CCOCC2)cc1 Show InChI InChI=1S/C27H34N2O5/c1-31-23-9-6-21(7-10-23)5-8-22-19-24(32-2)20-26(33-3)25(22)11-12-27(30)28-13-4-14-29-15-17-34-18-16-29/h5-12,19-20H,4,13-18H2,1-3H3,(H,28,30)/b8-5+,12-11+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8.92E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429261
(CHEMBL2334142)Show SMILES CCCCCCNC(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C26H33NO4/c1-5-6-7-8-17-27-26(28)16-15-24-21(18-23(30-3)19-25(24)31-4)12-9-20-10-13-22(29-2)14-11-20/h9-16,18-19H,5-8,17H2,1-4H3,(H,27,28)/b12-9+,16-15+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8.99E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429283
(CHEMBL2333744)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NCC#C)cc1 Show InChI InChI=1S/C23H23NO4/c1-5-14-24-23(25)13-12-21-18(15-20(27-3)16-22(21)28-4)9-6-17-7-10-19(26-2)11-8-17/h1,6-13,15-16H,14H2,2-4H3,(H,24,25)/b9-6+,13-12+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9.08E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429289
(CHEMBL2334133)Show SMILES CCCCCCN(CCCCCC)C(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C32H45NO4/c1-6-8-10-12-22-33(23-13-11-9-7-2)32(34)21-20-30-27(24-29(36-4)25-31(30)37-5)17-14-26-15-18-28(35-3)19-16-26/h14-21,24-25H,6-13,22-23H2,1-5H3/b17-14+,21-20+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9.08E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429298
(CHEMBL2333751)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NCc2ccco2)cc1 Show InChI InChI=1S/C25H25NO5/c1-28-20-10-7-18(8-11-20)6-9-19-15-22(29-2)16-24(30-3)23(19)12-13-25(27)26-17-21-5-4-14-31-21/h4-16H,17H2,1-3H3,(H,26,27)/b9-6+,13-12+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 9.67E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429292
(CHEMBL2334130)Show SMILES CCCCN(CCCC)C(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C28H37NO4/c1-6-8-18-29(19-9-7-2)28(30)17-16-26-23(20-25(32-4)21-27(26)33-5)13-10-22-11-14-24(31-3)15-12-22/h10-17,20-21H,6-9,18-19H2,1-5H3/b13-10+,17-16+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.01E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429272
(CHEMBL2333734)Show SMILES CCC1CCCCN1C(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C27H33NO4/c1-5-22-8-6-7-17-28(22)27(29)16-15-25-21(18-24(31-3)19-26(25)32-4)12-9-20-10-13-23(30-2)14-11-20/h9-16,18-19,22H,5-8,17H2,1-4H3/b12-9+,16-15+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.03E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429274
(CHEMBL2334138)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCC(C)CC2)cc1 Show InChI InChI=1S/C26H31NO4/c1-19-13-15-27(16-14-19)26(28)12-11-24-21(17-23(30-3)18-25(24)31-4)8-5-20-6-9-22(29-2)10-7-20/h5-12,17-19H,13-16H2,1-4H3/b8-5+,12-11+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.03E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429281
(CHEMBL2333746)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NC(C)(C)C)cc1 Show InChI InChI=1S/C24H29NO4/c1-24(2,3)25-23(26)14-13-21-18(15-20(28-5)16-22(21)29-6)10-7-17-8-11-19(27-4)12-9-17/h7-16H,1-6H3,(H,25,26)/b10-7+,14-13+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.11E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429264
(CHEMBL2334139)Show SMILES CCNC(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C22H25NO4/c1-5-23-22(24)13-12-20-17(14-19(26-3)15-21(20)27-4)9-6-16-7-10-18(25-2)11-8-16/h6-15H,5H2,1-4H3,(H,23,24)/b9-6+,13-12+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.24E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429278
(CHEMBL2333749)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NC2CC2)cc1 Show InChI InChI=1S/C23H25NO4/c1-26-19-10-5-16(6-11-19)4-7-17-14-20(27-2)15-22(28-3)21(17)12-13-23(25)24-18-8-9-18/h4-7,10-15,18H,8-9H2,1-3H3,(H,24,25)/b7-4+,13-12+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.30E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429295
(CHEMBL2333754)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N(C)C)cc1 Show InChI InChI=1S/C22H25NO4/c1-23(2)22(24)13-12-20-17(14-19(26-4)15-21(20)27-5)9-6-16-7-10-18(25-3)11-8-16/h6-15H,1-5H3/b9-6+,13-12+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.30E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429286
(CHEMBL2334143)Show SMILES CCCCCCCCNC(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C28H37NO4/c1-5-6-7-8-9-10-19-29-28(30)18-17-26-23(20-25(32-3)21-27(26)33-4)14-11-22-12-15-24(31-2)16-13-22/h11-18,20-21H,5-10,19H2,1-4H3,(H,29,30)/b14-11+,18-17+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.38E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429280
(CHEMBL2333747)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NCC(C)C)cc1 Show InChI InChI=1S/C24H29NO4/c1-17(2)16-25-24(26)13-12-22-19(14-21(28-4)15-23(22)29-5)9-6-18-7-10-20(27-3)11-8-18/h6-15,17H,16H2,1-5H3,(H,25,26)/b9-6+,13-12+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.51E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50429287
(CHEMBL2334135)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCCCC2)cc1 Show InChI InChI=1S/C25H29NO4/c1-28-21-11-8-19(9-12-21)7-10-20-17-22(29-2)18-24(30-3)23(20)13-14-25(27)26-15-5-4-6-16-26/h7-14,17-18H,4-6,15-16H2,1-3H3/b10-7+,14-13+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.53E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429290
(CHEMBL2334132)Show SMILES CCCCCN(CCCCC)C(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C30H41NO4/c1-6-8-10-20-31(21-11-9-7-2)30(32)19-18-28-25(22-27(34-4)23-29(28)35-5)15-12-24-13-16-26(33-3)17-14-24/h12-19,22-23H,6-11,20-21H2,1-5H3/b15-12+,19-18+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.64E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429286
(CHEMBL2334143)Show SMILES CCCCCCCCNC(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C28H37NO4/c1-5-6-7-8-9-10-19-29-28(30)18-17-26-23(20-25(32-3)21-27(26)33-4)14-11-22-12-15-24(31-2)16-13-22/h11-18,20-21H,5-10,19H2,1-4H3,(H,29,30)/b14-11+,18-17+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.01E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50429287
(CHEMBL2334135)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCCCC2)cc1 Show InChI InChI=1S/C25H29NO4/c1-28-21-11-8-19(9-12-21)7-10-20-17-22(29-2)18-24(30-3)23(20)13-14-25(27)26-15-5-4-6-16-26/h7-14,17-18H,4-6,15-16H2,1-3H3/b10-7+,14-13+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.32E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-2 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM11639
(4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyraz...)Show SMILES Cc1ccc(cc1)-c1cc(nn1-c1ccc(cc1)S(N)(=O)=O)C(F)(F)F Show InChI InChI=1S/C17H14F3N3O2S/c1-11-2-4-12(5-3-11)15-10-16(17(18,19)20)22-23(15)13-6-8-14(9-7-13)26(21,24)25/h2-10H,1H3,(H2,21,24,25) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.75E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429298
(CHEMBL2333751)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NCc2ccco2)cc1 Show InChI InChI=1S/C25H25NO5/c1-28-20-10-7-18(8-11-20)6-9-19-15-22(29-2)16-24(30-3)23(19)12-13-25(27)26-17-21-5-4-14-31-21/h4-16H,17H2,1-3H3,(H,26,27)/b9-6+,13-12+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.91E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429285
(CHEMBL2333742)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NCCCl)cc1 Show InChI InChI=1S/C22H24ClNO4/c1-26-18-8-5-16(6-9-18)4-7-17-14-19(27-2)15-21(28-3)20(17)10-11-22(25)24-13-12-23/h4-11,14-15H,12-13H2,1-3H3,(H,24,25)/b7-4+,11-10+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.23E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429261
(CHEMBL2334142)Show SMILES CCCCCCNC(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C26H33NO4/c1-5-6-7-8-17-27-26(28)16-15-24-21(18-23(30-3)19-25(24)31-4)12-9-20-10-13-22(29-2)14-11-20/h9-16,18-19H,5-8,17H2,1-4H3,(H,27,28)/b12-9+,16-15+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.47E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429288
(CHEMBL2334134)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N(CC=C)CC=C)cc1 Show InChI InChI=1S/C26H29NO4/c1-6-16-27(17-7-2)26(28)15-14-24-21(18-23(30-4)19-25(24)31-5)11-8-20-9-12-22(29-3)13-10-20/h6-15,18-19H,1-2,16-17H2,3-5H3/b11-8+,15-14+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429264
(CHEMBL2334139)Show SMILES CCNC(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C22H25NO4/c1-5-23-22(24)13-12-20-17(14-19(26-3)15-21(20)27-4)9-6-16-7-10-18(25-2)11-8-16/h6-15H,5H2,1-4H3,(H,23,24)/b9-6+,13-12+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.54E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429284
(CHEMBL2333743)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NCCCCl)cc1 Show InChI InChI=1S/C23H26ClNO4/c1-27-19-9-6-17(7-10-19)5-8-18-15-20(28-2)16-22(29-3)21(18)11-12-23(26)25-14-4-13-24/h5-12,15-16H,4,13-14H2,1-3H3,(H,25,26)/b8-5+,12-11+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.84E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429269
(CHEMBL2333737)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCN(C)CC2)cc1 Show InChI InChI=1S/C25H30N2O4/c1-26-13-15-27(16-14-26)25(28)12-11-23-20(17-22(30-3)18-24(23)31-4)8-5-19-6-9-21(29-2)10-7-19/h5-12,17-18H,13-16H2,1-4H3/b8-5+,12-11+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.91E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429282
(CHEMBL2333745)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NC(C)C)cc1 Show InChI InChI=1S/C23H27NO4/c1-16(2)24-23(25)13-12-21-18(14-20(27-4)15-22(21)28-5)9-6-17-7-10-19(26-3)11-8-17/h6-16H,1-5H3,(H,24,25)/b9-6+,13-12+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.04E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429271
(CHEMBL2333735)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCC(Cl)CC2)cc1 Show InChI InChI=1S/C25H28ClNO4/c1-29-21-8-5-18(6-9-21)4-7-19-16-22(30-2)17-24(31-3)23(19)10-11-25(28)27-14-12-20(26)13-15-27/h4-11,16-17,20H,12-15H2,1-3H3/b7-4+,11-10+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.06E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429273
(CHEMBL2333733)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CC(C)CC(C)C2)cc1 Show InChI InChI=1S/C27H33NO4/c1-19-14-20(2)18-28(17-19)27(29)13-12-25-22(15-24(31-4)16-26(25)32-5)9-6-21-7-10-23(30-3)11-8-21/h6-13,15-16,19-20H,14,17-18H2,1-5H3/b9-6+,13-12+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.51E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429267
(CHEMBL2333739)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCSCC2)cc1 Show InChI InChI=1S/C24H27NO4S/c1-27-20-8-5-18(6-9-20)4-7-19-16-21(28-2)17-23(29-3)22(19)10-11-24(26)25-12-14-30-15-13-25/h4-11,16-17H,12-15H2,1-3H3/b7-4+,11-10+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.52E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429293
(CHEMBL2334129)Show SMILES CCCN(CCC)C(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C26H33NO4/c1-6-16-27(17-7-2)26(28)15-14-24-21(18-23(30-4)19-25(24)31-5)11-8-20-9-12-22(29-3)13-10-20/h8-15,18-19H,6-7,16-17H2,1-5H3/b11-8+,15-14+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.59E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429280
(CHEMBL2333747)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NCC(C)C)cc1 Show InChI InChI=1S/C24H29NO4/c1-17(2)16-25-24(26)13-12-22-19(14-21(28-4)15-23(22)29-5)9-6-18-7-10-20(27-3)11-8-18/h6-15,17H,16H2,1-5H3,(H,25,26)/b9-6+,13-12+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429278
(CHEMBL2333749)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NC2CC2)cc1 Show InChI InChI=1S/C23H25NO4/c1-26-19-10-5-16(6-11-19)4-7-17-14-20(27-2)15-22(28-3)21(17)12-13-23(25)24-18-8-9-18/h4-7,10-15,18H,8-9H2,1-3H3,(H,24,25)/b7-4+,13-12+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429270
(CHEMBL2333736)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCC(CC2)c2ccccc2)cc1 Show InChI InChI=1S/C31H33NO4/c1-34-27-13-10-23(11-14-27)9-12-26-21-28(35-2)22-30(36-3)29(26)15-16-31(33)32-19-17-25(18-20-32)24-7-5-4-6-8-24/h4-16,21-22,25H,17-20H2,1-3H3/b12-9+,16-15+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429279
(CHEMBL2333748)Show SMILES CCC(C)NC(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C24H29NO4/c1-6-17(2)25-24(26)14-13-22-19(15-21(28-4)16-23(22)29-5)10-7-18-8-11-20(27-3)12-9-18/h7-17H,6H2,1-5H3,(H,25,26)/b10-7+,14-13+ | PDB
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| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429263
(CHEMBL2334140)Show SMILES CCCNC(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C23H27NO4/c1-5-14-24-23(25)13-12-21-18(15-20(27-3)16-22(21)28-4)9-6-17-7-10-19(26-2)11-8-17/h6-13,15-16H,5,14H2,1-4H3,(H,24,25)/b9-6+,13-12+ | PDB
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| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429287
(CHEMBL2334135)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCCCC2)cc1 Show InChI InChI=1S/C25H29NO4/c1-28-21-11-8-19(9-12-21)7-10-20-17-22(29-2)18-24(30-3)23(20)13-14-25(27)26-15-5-4-6-16-26/h7-14,17-18H,4-6,15-16H2,1-3H3/b10-7+,14-13+ | PDB
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| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429296
(CHEMBL2333753)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)Nc2cc(OC)c(OC)c(OC)c2)cc1 Show InChI InChI=1S/C29H31NO7/c1-32-22-11-8-19(9-12-22)7-10-20-15-23(33-2)18-25(34-3)24(20)13-14-28(31)30-21-16-26(35-4)29(37-6)27(17-21)36-5/h7-18H,1-6H3,(H,30,31)/b10-7+,14-13+ | PDB
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| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429294
(CHEMBL2333755)Show SMILES CCN(CC)C(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C24H29NO4/c1-6-25(7-2)24(26)15-14-22-19(16-21(28-4)17-23(22)29-5)11-8-18-9-12-20(27-3)13-10-18/h8-17H,6-7H2,1-5H3/b11-8+,15-14+ | PDB
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| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429291
(CHEMBL2334131)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N(CC(C)C)CC(C)C)cc1 Show InChI InChI=1S/C28H37NO4/c1-20(2)18-29(19-21(3)4)28(30)15-14-26-23(16-25(32-6)17-27(26)33-7)11-8-22-9-12-24(31-5)13-10-22/h8-17,20-21H,18-19H2,1-7H3/b11-8+,15-14+ | PDB
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| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429289
(CHEMBL2334133)Show SMILES CCCCCCN(CCCCCC)C(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C32H45NO4/c1-6-8-10-12-22-33(23-13-11-9-7-2)32(34)21-20-30-27(24-29(36-4)25-31(30)37-5)17-14-26-15-18-28(35-3)19-16-26/h14-21,24-25H,6-13,22-23H2,1-5H3/b17-14+,21-20+ | PDB
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| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429274
(CHEMBL2334138)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCC(C)CC2)cc1 Show InChI InChI=1S/C26H31NO4/c1-19-13-15-27(16-14-19)26(28)12-11-24-21(17-23(30-3)18-25(24)31-4)8-5-20-6-9-22(29-2)10-7-20/h5-12,17-19H,13-16H2,1-4H3/b8-5+,12-11+ | PDB
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| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429283
(CHEMBL2333744)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NCC#C)cc1 Show InChI InChI=1S/C23H23NO4/c1-5-14-24-23(25)13-12-21-18(15-20(27-3)16-22(21)28-4)9-6-17-7-10-19(26-2)11-8-17/h1,6-13,15-16H,14H2,2-4H3,(H,24,25)/b9-6+,13-12+ | PDB
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| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429262
(CHEMBL2334141)Show SMILES CCCCNC(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C24H29NO4/c1-5-6-15-25-24(26)14-13-22-19(16-21(28-3)17-23(22)29-4)10-7-18-8-11-20(27-2)12-9-18/h7-14,16-17H,5-6,15H2,1-4H3,(H,25,26)/b10-7+,14-13+ | PDB
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| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429276
(CHEMBL2334136)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCCCC2C)cc1 Show InChI InChI=1S/C26H31NO4/c1-19-7-5-6-16-27(19)26(28)15-14-24-21(17-23(30-3)18-25(24)31-4)11-8-20-9-12-22(29-2)13-10-20/h8-15,17-19H,5-7,16H2,1-4H3/b11-8+,15-14+ | PDB
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| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429272
(CHEMBL2333734)Show SMILES CCC1CCCCN1C(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C27H33NO4/c1-5-22-8-6-7-17-28(22)27(29)16-15-25-21(18-24(31-3)19-26(25)32-4)12-9-20-10-13-23(30-2)14-11-20/h9-16,18-19,22H,5-8,17H2,1-4H3/b12-9+,16-15+ | PDB
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| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429268
(CHEMBL2333738)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCOCC2)cc1 Show InChI InChI=1S/C24H27NO5/c1-27-20-8-5-18(6-9-20)4-7-19-16-21(28-2)17-23(29-3)22(19)10-11-24(26)25-12-14-30-15-13-25/h4-11,16-17H,12-15H2,1-3H3/b7-4+,11-10+ | PDB
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| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429266
(CHEMBL2333740)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCCC2)cc1 Show InChI InChI=1S/C24H27NO4/c1-27-20-10-7-18(8-11-20)6-9-19-16-21(28-2)17-23(29-3)22(19)12-13-24(26)25-14-4-5-15-25/h6-13,16-17H,4-5,14-15H2,1-3H3/b9-6+,13-12+ | PDB
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| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429277
(CHEMBL2333750)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NC2CCCCC2)cc1 Show InChI InChI=1S/C26H31NO4/c1-29-22-13-10-19(11-14-22)9-12-20-17-23(30-2)18-25(31-3)24(20)15-16-26(28)27-21-7-5-4-6-8-21/h9-18,21H,4-8H2,1-3H3,(H,27,28)/b12-9+,16-15+ | PDB
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| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429292
(CHEMBL2334130)Show SMILES CCCCN(CCCC)C(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C28H37NO4/c1-6-8-18-29(19-9-7-2)28(30)17-16-26-23(20-25(32-4)21-27(26)33-5)13-10-22-11-14-24(31-3)15-12-22/h10-17,20-21H,6-9,18-19H2,1-5H3/b13-10+,17-16+ | PDB
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| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429275
(CHEMBL2334137)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N2CCCC(C)C2)cc1 Show InChI InChI=1S/C26H31NO4/c1-19-6-5-15-27(18-19)26(28)14-13-24-21(16-23(30-3)17-25(24)31-4)10-7-20-8-11-22(29-2)12-9-20/h7-14,16-17,19H,5-6,15,18H2,1-4H3/b10-7+,14-13+ | PDB
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| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429297
(CHEMBL2333752)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NCCCN2CCOCC2)cc1 Show InChI InChI=1S/C27H34N2O5/c1-31-23-9-6-21(7-10-23)5-8-22-19-24(32-2)20-26(33-3)25(22)11-12-27(30)28-13-4-14-29-15-17-34-18-16-29/h5-12,19-20H,4,13-18H2,1-3H3,(H,28,30)/b8-5+,12-11+ | PDB
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| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429290
(CHEMBL2334132)Show SMILES CCCCCN(CCCCC)C(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C30H41NO4/c1-6-8-10-20-31(21-11-9-7-2)30(32)19-18-28-25(22-27(34-4)23-29(28)35-5)15-12-24-13-16-26(33-3)17-14-24/h12-19,22-23H,6-11,20-21H2,1-5H3/b15-12+,19-18+ | PDB
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| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429286
(CHEMBL2334143)Show SMILES CCCCCCCCNC(=O)\C=C\c1c(OC)cc(OC)cc1\C=C\c1ccc(OC)cc1 Show InChI InChI=1S/C28H37NO4/c1-5-6-7-8-9-10-19-29-28(30)18-17-26-23(20-25(32-3)21-27(26)33-4)14-11-22-12-15-24(31-2)16-13-22/h11-18,20-21H,5-10,19H2,1-4H3,(H,29,30)/b14-11+,18-17+ | PDB
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429295
(CHEMBL2333754)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)N(C)C)cc1 Show InChI InChI=1S/C22H25NO4/c1-23(2)22(24)13-12-20-17(14-19(26-4)15-21(20)27-5)9-6-16-7-10-18(25-3)11-8-16/h6-15H,1-5H3/b9-6+,13-12+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429281
(CHEMBL2333746)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NC(C)(C)C)cc1 Show InChI InChI=1S/C24H29NO4/c1-24(2,3)25-23(26)14-13-21-18(15-20(28-5)16-22(21)29-6)10-7-17-8-11-19(27-4)12-9-17/h7-16H,1-6H3,(H,25,26)/b10-7+,14-13+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50429265
(CHEMBL2333741)Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(O)=O)cc1 Show InChI InChI=1S/C20H20O5/c1-23-16-8-5-14(6-9-16)4-7-15-12-17(24-2)13-19(25-3)18(15)10-11-20(21)22/h4-13H,1-3H3,(H,21,22)/b7-4+,11-10+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hefei University of Technology
Curated by ChEMBL
| Assay Description
Inhibition of COX-1 (unknown origin) by chemiluminescence assay |
Eur J Med Chem 62: 222-31 (2013)
Article DOI: 10.1016/j.ejmech.2012.11.021
BindingDB Entry DOI: 10.7270/Q2M90B0F |
More data for this
Ligand-Target Pair | |
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