Found 40 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
(Ovis aries (Sheep)) | BDBM50158187
(1-fluoro-4-{(E)-2-[4-(methylsulfonyl)phenyl]-2-phe...)Show SMILES CS(=O)(=O)c1ccc(cc1)C(=C\c1ccc(F)cc1)\c1ccccc1 Show InChI InChI=1S/C21H17FO2S/c1-25(23,24)20-13-9-18(10-14-20)21(17-5-3-2-4-6-17)15-16-7-11-19(22)12-8-16/h2-15H,1H3/b21-15+ | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 32 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-2 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM50158187
(1-fluoro-4-{(E)-2-[4-(methylsulfonyl)phenyl]-2-phe...)Show SMILES CS(=O)(=O)c1ccc(cc1)C(=C\c1ccc(F)cc1)\c1ccccc1 Show InChI InChI=1S/C21H17FO2S/c1-25(23,24)20-13-9-18(10-14-20)21(17-5-3-2-4-6-17)15-16-7-11-19(22)12-8-16/h2-15H,1H3/b21-15+ | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 32 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-2 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | 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
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| Purchase
CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
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| PDB Article PubMed
| n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-2 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | 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
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UniProtKB/SwissProt
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| Purchase
CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
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| PDB Article PubMed
| n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-2 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM50158193
(1-chloro-4-{(E)-2-[4-(methylsulfonyl)phenyl]-2-phe...)Show SMILES CS(=O)(=O)c1ccc(cc1)C(=C\c1ccc(Cl)cc1)\c1ccccc1 Show InChI InChI=1S/C21H17ClO2S/c1-25(23,24)20-13-9-18(10-14-20)21(17-5-3-2-4-6-17)15-16-7-11-19(22)12-8-16/h2-15H,1H3/b21-15+ | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 114 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-2 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM50158193
(1-chloro-4-{(E)-2-[4-(methylsulfonyl)phenyl]-2-phe...)Show SMILES CS(=O)(=O)c1ccc(cc1)C(=C\c1ccc(Cl)cc1)\c1ccccc1 Show InChI InChI=1S/C21H17ClO2S/c1-25(23,24)20-13-9-18(10-14-20)21(17-5-3-2-4-6-17)15-16-7-11-19(22)12-8-16/h2-15H,1H3/b21-15+ | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 114 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-2 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM50158188
(1-(1,2-Diphenyl-vinyl)-4-methanesulfonyl-benzene |...)Show SMILES CS(=O)(=O)c1ccc(cc1)C(=C\c1ccccc1)\c1ccccc1 Show InChI InChI=1S/C21H18O2S/c1-24(22,23)20-14-12-19(13-15-20)21(18-10-6-3-7-11-18)16-17-8-4-2-5-9-17/h2-16H,1H3/b21-16+ | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 130 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-2 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM50158188
(1-(1,2-Diphenyl-vinyl)-4-methanesulfonyl-benzene |...)Show SMILES CS(=O)(=O)c1ccc(cc1)C(=C\c1ccccc1)\c1ccccc1 Show InChI InChI=1S/C21H18O2S/c1-24(22,23)20-14-12-19(13-15-20)21(18-10-6-3-7-11-18)16-17-8-4-2-5-9-17/h2-16H,1H3/b21-16+ | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 130 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-2 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50158188
(1-(1,2-Diphenyl-vinyl)-4-methanesulfonyl-benzene |...)Show SMILES CS(=O)(=O)c1ccc(cc1)C(=C\c1ccccc1)\c1ccccc1 Show InChI InChI=1S/C21H18O2S/c1-24(22,23)20-14-12-19(13-15-20)21(18-10-6-3-7-11-18)16-17-8-4-2-5-9-17/h2-16H,1H3/b21-16+ | PDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-1 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50158188
(1-(1,2-Diphenyl-vinyl)-4-methanesulfonyl-benzene |...)Show SMILES CS(=O)(=O)c1ccc(cc1)C(=C\c1ccccc1)\c1ccccc1 Show InChI InChI=1S/C21H18O2S/c1-24(22,23)20-14-12-19(13-15-20)21(18-10-6-3-7-11-18)16-17-8-4-2-5-9-17/h2-16H,1H3/b21-16+ | PDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-1 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM22369
(4-(4-methanesulfonylphenyl)-3-phenyl-2,5-dihydrofu...)Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)OC1)c1ccccc1 |t:11| Show InChI InChI=1S/C17H14O4S/c1-22(19,20)14-9-7-12(8-10-14)15-11-21-17(18)16(15)13-5-3-2-4-6-13/h2-10H,11H2,1H3 | PDB MMDB
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CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem
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| PDB Article PubMed
| n/a | n/a | 500 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-2 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM22369
(4-(4-methanesulfonylphenyl)-3-phenyl-2,5-dihydrofu...)Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)OC1)c1ccccc1 |t:11| Show InChI InChI=1S/C17H14O4S/c1-22(19,20)14-9-7-12(8-10-14)15-11-21-17(18)16(15)13-5-3-2-4-6-13/h2-10H,11H2,1H3 | PDB MMDB
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UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem
Patents
Similars
| PDB Article PubMed
| n/a | n/a | 500 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-2 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM50158190
(1,2-Difluoro-4-[2-(4-methanesulfonyl-phenyl)-2-phe...)Show SMILES CS(=O)(=O)c1ccc(cc1)C(=C\c1ccc(F)c(F)c1)\c1ccccc1 Show InChI InChI=1S/C21H16F2O2S/c1-26(24,25)18-10-8-17(9-11-18)19(16-5-3-2-4-6-16)13-15-7-12-20(22)21(23)14-15/h2-14H,1H3/b19-13+ | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 790 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-2 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM50158190
(1,2-Difluoro-4-[2-(4-methanesulfonyl-phenyl)-2-phe...)Show SMILES CS(=O)(=O)c1ccc(cc1)C(=C\c1ccc(F)c(F)c1)\c1ccccc1 Show InChI InChI=1S/C21H16F2O2S/c1-26(24,25)18-10-8-17(9-11-18)19(16-5-3-2-4-6-16)13-15-7-12-20(22)21(23)14-15/h2-14H,1H3/b19-13+ | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 790 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-2 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM50158191
(1-methyl-4-{(E)-2-[4-(methylsulfonyl)phenyl]-2-phe...)Show SMILES Cc1ccc(\C=C(/c2ccccc2)c2ccc(cc2)S(C)(=O)=O)cc1 Show InChI InChI=1S/C22H20O2S/c1-17-8-10-18(11-9-17)16-22(19-6-4-3-5-7-19)20-12-14-21(15-13-20)25(2,23)24/h3-16H,1-2H3/b22-16+ | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-2 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM50158191
(1-methyl-4-{(E)-2-[4-(methylsulfonyl)phenyl]-2-phe...)Show SMILES Cc1ccc(\C=C(/c2ccccc2)c2ccc(cc2)S(C)(=O)=O)cc1 Show InChI InChI=1S/C22H20O2S/c1-17-8-10-18(11-9-17)16-22(19-6-4-3-5-7-19)20-12-14-21(15-13-20)25(2,23)24/h3-16H,1-2H3/b22-16+ | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-2 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM50158189
(1-[2,2-bis(4-chlorophenyl)vinyl]-4-(methylsulfonyl...)Show SMILES [#6]S(=O)(=O)c1ccc(\[#6]=[#6](/c2ccc(Cl)cc2)-c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C21H16Cl2O2S/c1-26(24,25)20-12-2-15(3-13-20)14-21(16-4-8-18(22)9-5-16)17-6-10-19(23)11-7-17/h2-14H,1H3 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-2 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM50158189
(1-[2,2-bis(4-chlorophenyl)vinyl]-4-(methylsulfonyl...)Show SMILES [#6]S(=O)(=O)c1ccc(\[#6]=[#6](/c2ccc(Cl)cc2)-c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C21H16Cl2O2S/c1-26(24,25)20-12-2-15(3-13-20)14-21(16-4-8-18(22)9-5-16)17-6-10-19(23)11-7-17/h2-14H,1H3 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-2 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM50158194
(1-[2,2-bis(4-methylphenyl)vinyl]-4-(methylsulfonyl...)Show SMILES [#6]-c1ccc(cc1)-[#6](=[#6]/c1ccc(cc1)S([#6])(=O)=O)\c1ccc(-[#6])cc1 Show InChI InChI=1S/C23H22O2S/c1-17-4-10-20(11-5-17)23(21-12-6-18(2)7-13-21)16-19-8-14-22(15-9-19)26(3,24)25/h4-16H,1-3H3 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 3.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-2 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM50158194
(1-[2,2-bis(4-methylphenyl)vinyl]-4-(methylsulfonyl...)Show SMILES [#6]-c1ccc(cc1)-[#6](=[#6]/c1ccc(cc1)S([#6])(=O)=O)\c1ccc(-[#6])cc1 Show InChI InChI=1S/C23H22O2S/c1-17-4-10-20(11-5-17)23(21-12-6-18(2)7-13-21)16-19-8-14-22(15-9-19)26(3,24)25/h4-16H,1-3H3 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 3.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-2 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM50158192
(1-[2,2-bis(4-fluorophenyl)vinyl]-4-(methylsulfonyl...)Show SMILES [#6]S(=O)(=O)c1ccc(\[#6]=[#6](/c2ccc(F)cc2)-c2ccc(F)cc2)cc1 Show InChI InChI=1S/C21H16F2O2S/c1-26(24,25)20-12-2-15(3-13-20)14-21(16-4-8-18(22)9-5-16)17-6-10-19(23)11-7-17/h2-14H,1H3 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 3.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-2 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM50158192
(1-[2,2-bis(4-fluorophenyl)vinyl]-4-(methylsulfonyl...)Show SMILES [#6]S(=O)(=O)c1ccc(\[#6]=[#6](/c2ccc(F)cc2)-c2ccc(F)cc2)cc1 Show InChI InChI=1S/C21H16F2O2S/c1-26(24,25)20-12-2-15(3-13-20)14-21(16-4-8-18(22)9-5-16)17-6-10-19(23)11-7-17/h2-14H,1H3 | PDB MMDB
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| CHEMBL PC cid PC sid UniChem
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| Article PubMed
| n/a | n/a | 3.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-2 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | 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
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| n/a | n/a | 3.31E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-1 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | 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
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| n/a | n/a | 3.31E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-1 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM22369
(4-(4-methanesulfonylphenyl)-3-phenyl-2,5-dihydrofu...)Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)OC1)c1ccccc1 |t:11| Show InChI InChI=1S/C17H14O4S/c1-22(19,20)14-9-7-12(8-10-14)15-11-21-17(18)16(15)13-5-3-2-4-6-13/h2-10H,11H2,1H3 | PDB
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-1 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50158194
(1-[2,2-bis(4-methylphenyl)vinyl]-4-(methylsulfonyl...)Show SMILES [#6]-c1ccc(cc1)-[#6](=[#6]/c1ccc(cc1)S([#6])(=O)=O)\c1ccc(-[#6])cc1 Show InChI InChI=1S/C23H22O2S/c1-17-4-10-20(11-5-17)23(21-12-6-18(2)7-13-21)16-19-8-14-22(15-9-19)26(3,24)25/h4-16H,1-3H3 | PDB
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-1 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50158194
(1-[2,2-bis(4-methylphenyl)vinyl]-4-(methylsulfonyl...)Show SMILES [#6]-c1ccc(cc1)-[#6](=[#6]/c1ccc(cc1)S([#6])(=O)=O)\c1ccc(-[#6])cc1 Show InChI InChI=1S/C23H22O2S/c1-17-4-10-20(11-5-17)23(21-12-6-18(2)7-13-21)16-19-8-14-22(15-9-19)26(3,24)25/h4-16H,1-3H3 | PDB
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-1 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50158190
(1,2-Difluoro-4-[2-(4-methanesulfonyl-phenyl)-2-phe...)Show SMILES CS(=O)(=O)c1ccc(cc1)C(=C\c1ccc(F)c(F)c1)\c1ccccc1 Show InChI InChI=1S/C21H16F2O2S/c1-26(24,25)18-10-8-17(9-11-18)19(16-5-3-2-4-6-16)13-15-7-12-20(22)21(23)14-15/h2-14H,1H3/b19-13+ | PDB
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-1 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50158192
(1-[2,2-bis(4-fluorophenyl)vinyl]-4-(methylsulfonyl...)Show SMILES [#6]S(=O)(=O)c1ccc(\[#6]=[#6](/c2ccc(F)cc2)-c2ccc(F)cc2)cc1 Show InChI InChI=1S/C21H16F2O2S/c1-26(24,25)20-12-2-15(3-13-20)14-21(16-4-8-18(22)9-5-16)17-6-10-19(23)11-7-17/h2-14H,1H3 | PDB
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| CHEMBL PC cid PC sid UniChem
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-1 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50158189
(1-[2,2-bis(4-chlorophenyl)vinyl]-4-(methylsulfonyl...)Show SMILES [#6]S(=O)(=O)c1ccc(\[#6]=[#6](/c2ccc(Cl)cc2)-c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C21H16Cl2O2S/c1-26(24,25)20-12-2-15(3-13-20)14-21(16-4-8-18(22)9-5-16)17-6-10-19(23)11-7-17/h2-14H,1H3 | PDB
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| CHEMBL PC cid PC sid UniChem
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-1 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50158192
(1-[2,2-bis(4-fluorophenyl)vinyl]-4-(methylsulfonyl...)Show SMILES [#6]S(=O)(=O)c1ccc(\[#6]=[#6](/c2ccc(F)cc2)-c2ccc(F)cc2)cc1 Show InChI InChI=1S/C21H16F2O2S/c1-26(24,25)20-12-2-15(3-13-20)14-21(16-4-8-18(22)9-5-16)17-6-10-19(23)11-7-17/h2-14H,1H3 | PDB
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UniProtKB/SwissProt
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| CHEMBL PC cid PC sid UniChem
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| Article PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-1 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50158187
(1-fluoro-4-{(E)-2-[4-(methylsulfonyl)phenyl]-2-phe...)Show SMILES CS(=O)(=O)c1ccc(cc1)C(=C\c1ccc(F)cc1)\c1ccccc1 Show InChI InChI=1S/C21H17FO2S/c1-25(23,24)20-13-9-18(10-14-20)21(17-5-3-2-4-6-17)15-16-7-11-19(22)12-8-16/h2-15H,1H3/b21-15+ | PDB
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| CHEMBL PC cid PC sid UniChem
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-1 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50158191
(1-methyl-4-{(E)-2-[4-(methylsulfonyl)phenyl]-2-phe...)Show SMILES Cc1ccc(\C=C(/c2ccccc2)c2ccc(cc2)S(C)(=O)=O)cc1 Show InChI InChI=1S/C22H20O2S/c1-17-8-10-18(11-9-17)16-22(19-6-4-3-5-7-19)20-12-14-21(15-13-20)25(2,23)24/h3-16H,1-2H3/b22-16+ | PDB
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| CHEMBL PC cid PC sid UniChem
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-1 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM22369
(4-(4-methanesulfonylphenyl)-3-phenyl-2,5-dihydrofu...)Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)OC1)c1ccccc1 |t:11| Show InChI InChI=1S/C17H14O4S/c1-22(19,20)14-9-7-12(8-10-14)15-11-21-17(18)16(15)13-5-3-2-4-6-13/h2-10H,11H2,1H3 | PDB
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-1 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50158191
(1-methyl-4-{(E)-2-[4-(methylsulfonyl)phenyl]-2-phe...)Show SMILES Cc1ccc(\C=C(/c2ccccc2)c2ccc(cc2)S(C)(=O)=O)cc1 Show InChI InChI=1S/C22H20O2S/c1-17-8-10-18(11-9-17)16-22(19-6-4-3-5-7-19)20-12-14-21(15-13-20)25(2,23)24/h3-16H,1-2H3/b22-16+ | PDB
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-1 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50158189
(1-[2,2-bis(4-chlorophenyl)vinyl]-4-(methylsulfonyl...)Show SMILES [#6]S(=O)(=O)c1ccc(\[#6]=[#6](/c2ccc(Cl)cc2)-c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C21H16Cl2O2S/c1-26(24,25)20-12-2-15(3-13-20)14-21(16-4-8-18(22)9-5-16)17-6-10-19(23)11-7-17/h2-14H,1H3 | PDB
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| CHEMBL PC cid PC sid UniChem
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-1 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50158193
(1-chloro-4-{(E)-2-[4-(methylsulfonyl)phenyl]-2-phe...)Show SMILES CS(=O)(=O)c1ccc(cc1)C(=C\c1ccc(Cl)cc1)\c1ccccc1 Show InChI InChI=1S/C21H17ClO2S/c1-25(23,24)20-13-9-18(10-14-20)21(17-5-3-2-4-6-17)15-16-7-11-19(22)12-8-16/h2-15H,1H3/b21-15+ | PDB
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UniProtKB/SwissProt
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| CHEMBL PC cid PC sid UniChem
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| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-1 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50158187
(1-fluoro-4-{(E)-2-[4-(methylsulfonyl)phenyl]-2-phe...)Show SMILES CS(=O)(=O)c1ccc(cc1)C(=C\c1ccc(F)cc1)\c1ccccc1 Show InChI InChI=1S/C21H17FO2S/c1-25(23,24)20-13-9-18(10-14-20)21(17-5-3-2-4-6-17)15-16-7-11-19(22)12-8-16/h2-15H,1H3/b21-15+ | PDB
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UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-1 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50158190
(1,2-Difluoro-4-[2-(4-methanesulfonyl-phenyl)-2-phe...)Show SMILES CS(=O)(=O)c1ccc(cc1)C(=C\c1ccc(F)c(F)c1)\c1ccccc1 Show InChI InChI=1S/C21H16F2O2S/c1-26(24,25)18-10-8-17(9-11-18)19(16-5-3-2-4-6-16)13-15-7-12-20(22)21(23)14-15/h2-14H,1H3/b19-13+ | PDB
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UniProtKB/SwissProt
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| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-1 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50158193
(1-chloro-4-{(E)-2-[4-(methylsulfonyl)phenyl]-2-phe...)Show SMILES CS(=O)(=O)c1ccc(cc1)C(=C\c1ccc(Cl)cc1)\c1ccccc1 Show InChI InChI=1S/C21H17ClO2S/c1-25(23,24)20-13-9-18(10-14-20)21(17-5-3-2-4-6-17)15-16-7-11-19(22)12-8-16/h2-15H,1H3/b21-15+ | PDB
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UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory concentration against ovine Cyclooxygenase-1 |
Bioorg Med Chem Lett 15: 439-42 (2004)
Article DOI: 10.1016/j.bmcl.2004.10.050 BindingDB Entry DOI: 10.7270/Q2GF0T0C |
More data for this Ligand-Target Pair | |