Found 6 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)) | 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
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
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CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| PDB Article PubMed
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
The University of the West Indies
Curated by ChEMBL
| Assay Description Inhibition of ovine COX2 |
Bioorg Med Chem 16: 276-83 (2008)
Article DOI: 10.1016/j.bmc.2007.09.038 BindingDB Entry DOI: 10.7270/Q22N520H |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM50225131
(2-sulfonamido-5-(4'-methoxyphenyl)-6-(4''-(methyls...)Show SMILES COc1ccc(cc1)-c1c(nc2sc(nn12)S(N)(=O)=O)-c1ccc(cc1)S(C)(=O)=O Show InChI InChI=1S/C18H16N4O5S3/c1-27-13-7-3-12(4-8-13)16-15(11-5-9-14(10-6-11)29(2,23)24)20-17-22(16)21-18(28-17)30(19,25)26/h3-10H,1-2H3,(H2,19,25,26) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 3.24E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
The University of the West Indies
Curated by ChEMBL
| Assay Description Inhibition of ovine COX2 |
Bioorg Med Chem 16: 276-83 (2008)
Article DOI: 10.1016/j.bmc.2007.09.038 BindingDB Entry DOI: 10.7270/Q22N520H |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM50225132
(2-trifluoromethyl-5-phenyl-6-(4''-(methylsulfonyl)...)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc2sc(nn2c1-c1ccccc1)C(F)(F)F Show InChI InChI=1S/C18H12F3N3O2S2/c1-28(25,26)13-9-7-11(8-10-13)14-15(12-5-3-2-4-6-12)24-17(22-14)27-16(23-24)18(19,20)21/h2-10H,1H3 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 4.79E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
The University of the West Indies
Curated by ChEMBL
| Assay Description Inhibition of ovine COX2 |
Bioorg Med Chem 16: 276-83 (2008)
Article DOI: 10.1016/j.bmc.2007.09.038 BindingDB Entry DOI: 10.7270/Q22N520H |
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
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 1.30E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
The University of the West Indies
Curated by ChEMBL
| Assay Description Inhibition of ovine COX1 |
Bioorg Med Chem 16: 276-83 (2008)
Article DOI: 10.1016/j.bmc.2007.09.038 BindingDB Entry DOI: 10.7270/Q22N520H |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50225132
(2-trifluoromethyl-5-phenyl-6-(4''-(methylsulfonyl)...)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc2sc(nn2c1-c1ccccc1)C(F)(F)F Show InChI InChI=1S/C18H12F3N3O2S2/c1-28(25,26)13-9-7-11(8-10-13)14-15(12-5-3-2-4-6-12)24-17(22-14)27-16(23-24)18(19,20)21/h2-10H,1H3 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD 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 |
The University of the West Indies
Curated by ChEMBL
| Assay Description Inhibition of ovine COX1 |
Bioorg Med Chem 16: 276-83 (2008)
Article DOI: 10.1016/j.bmc.2007.09.038 BindingDB Entry DOI: 10.7270/Q22N520H |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50225131
(2-sulfonamido-5-(4'-methoxyphenyl)-6-(4''-(methyls...)Show SMILES COc1ccc(cc1)-c1c(nc2sc(nn12)S(N)(=O)=O)-c1ccc(cc1)S(C)(=O)=O Show InChI InChI=1S/C18H16N4O5S3/c1-27-13-7-3-12(4-8-13)16-15(11-5-9-14(10-6-11)29(2,23)24)20-17-22(16)21-18(28-17)30(19,25)26/h3-10H,1-2H3,(H2,19,25,26) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD 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 |
The University of the West Indies
Curated by ChEMBL
| Assay Description Inhibition of ovine COX1 |
Bioorg Med Chem 16: 276-83 (2008)
Article DOI: 10.1016/j.bmc.2007.09.038 BindingDB Entry DOI: 10.7270/Q22N520H |
More data for this Ligand-Target Pair | |