Found 12 hits Enz. Inhib. hit(s) with all data for entry = 50033477 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
| Purchase
CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| PDB Article PubMed
| n/a | n/a | 60 | n/a | n/a | n/a | n/a | n/a | n/a |
Shahid Beheshti University (M.C)
Curated by ChEMBL
| Assay Description Inhibition of ovine COX2 by chemiluminescent assay |
Bioorg Med Chem Lett 19: 3162-5 (2009)
Article DOI: 10.1016/j.bmcl.2009.04.125 BindingDB Entry DOI: 10.7270/Q2XG9RGM |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM50346138
(3-benzyl-2-(4-(methylsulfonyl)phenyl)-1,3-thiazina...)Show InChI InChI=1S/C18H19NO3S2/c1-24(21,22)16-9-7-15(8-10-16)18-19(17(20)11-12-23-18)13-14-5-3-2-4-6-14/h2-10,18H,11-13H2,1H3 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 60 | n/a | n/a | n/a | n/a | n/a | n/a |
Shahid Beheshti University (M.C)
Curated by ChEMBL
| Assay Description Inhibition of ovine COX2 by chemiluminescent assay |
Bioorg Med Chem Lett 19: 3162-5 (2009)
Article DOI: 10.1016/j.bmcl.2009.04.125 BindingDB Entry DOI: 10.7270/Q2XG9RGM |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM50346139
(2-(4-(methylsulfonyl)phenyl)-3-phenethyl-1,3-thiaz...)Show InChI InChI=1S/C19H21NO3S2/c1-25(22,23)17-9-7-16(8-10-17)19-20(18(21)12-14-24-19)13-11-15-5-3-2-4-6-15/h2-10,19H,11-14H2,1H3 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
Shahid Beheshti University (M.C)
Curated by ChEMBL
| Assay Description Inhibition of ovine COX2 by chemiluminescent assay |
Bioorg Med Chem Lett 19: 3162-5 (2009)
Article DOI: 10.1016/j.bmcl.2009.04.125 BindingDB Entry DOI: 10.7270/Q2XG9RGM |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM50346141
(3-butyl-2-(4-(methylsulfonyl)phenyl)-1,3-thiazinan...)Show InChI InChI=1S/C15H21NO3S2/c1-3-4-10-16-14(17)9-11-20-15(16)12-5-7-13(8-6-12)21(2,18)19/h5-8,15H,3-4,9-11H2,1-2H3 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 80 | n/a | n/a | n/a | n/a | n/a | n/a |
Shahid Beheshti University (M.C)
Curated by ChEMBL
| Assay Description Inhibition of ovine COX2 by chemiluminescent assay |
Bioorg Med Chem Lett 19: 3162-5 (2009)
Article DOI: 10.1016/j.bmcl.2009.04.125 BindingDB Entry DOI: 10.7270/Q2XG9RGM |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM50346142
(2-(4-(methylsulfonyl)phenyl)-3-pentyl-1,3-thiazina...)Show InChI InChI=1S/C16H23NO3S2/c1-3-4-5-11-17-15(18)10-12-21-16(17)13-6-8-14(9-7-13)22(2,19)20/h6-9,16H,3-5,10-12H2,1-2H3 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 80 | n/a | n/a | n/a | n/a | n/a | n/a |
Shahid Beheshti University (M.C)
Curated by ChEMBL
| Assay Description Inhibition of ovine COX2 by chemiluminescent assay |
Bioorg Med Chem Lett 19: 3162-5 (2009)
Article DOI: 10.1016/j.bmcl.2009.04.125 BindingDB Entry DOI: 10.7270/Q2XG9RGM |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM50346140
(2-(4-(methylsulfonyl)phenyl)-3-propyl-1,3-thiazina...)Show InChI InChI=1S/C14H19NO3S2/c1-3-9-15-13(16)8-10-19-14(15)11-4-6-12(7-5-11)20(2,17)18/h4-7,14H,3,8-10H2,1-2H3 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 110 | n/a | n/a | n/a | n/a | n/a | n/a |
Shahid Beheshti University (M.C)
Curated by ChEMBL
| Assay Description Inhibition of ovine COX2 by chemiluminescent assay |
Bioorg Med Chem Lett 19: 3162-5 (2009)
Article DOI: 10.1016/j.bmcl.2009.04.125 BindingDB Entry DOI: 10.7270/Q2XG9RGM |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50346140
(2-(4-(methylsulfonyl)phenyl)-3-propyl-1,3-thiazina...)Show InChI InChI=1S/C14H19NO3S2/c1-3-9-15-13(16)8-10-19-14(15)11-4-6-12(7-5-11)20(2,17)18/h4-7,14H,3,8-10H2,1-2H3 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.41E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shahid Beheshti University (M.C)
Curated by ChEMBL
| Assay Description Inhibition of ovine COX1 by chemiluminescent assay |
Bioorg Med Chem Lett 19: 3162-5 (2009)
Article DOI: 10.1016/j.bmcl.2009.04.125 BindingDB Entry DOI: 10.7270/Q2XG9RGM |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50346141
(3-butyl-2-(4-(methylsulfonyl)phenyl)-1,3-thiazinan...)Show InChI InChI=1S/C15H21NO3S2/c1-3-4-10-16-14(17)9-11-20-15(16)12-5-7-13(8-6-12)21(2,18)19/h5-8,15H,3-4,9-11H2,1-2H3 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.48E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shahid Beheshti University (M.C)
Curated by ChEMBL
| Assay Description Inhibition of ovine COX1 by chemiluminescent assay |
Bioorg Med Chem Lett 19: 3162-5 (2009)
Article DOI: 10.1016/j.bmcl.2009.04.125 BindingDB Entry DOI: 10.7270/Q2XG9RGM |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50346142
(2-(4-(methylsulfonyl)phenyl)-3-pentyl-1,3-thiazina...)Show InChI InChI=1S/C16H23NO3S2/c1-3-4-5-11-17-15(18)10-12-21-16(17)13-6-8-14(9-7-13)22(2,19)20/h6-9,16H,3-5,10-12H2,1-2H3 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.49E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shahid Beheshti University (M.C)
Curated by ChEMBL
| Assay Description Inhibition of ovine COX1 by chemiluminescent assay |
Bioorg Med Chem Lett 19: 3162-5 (2009)
Article DOI: 10.1016/j.bmcl.2009.04.125 BindingDB Entry DOI: 10.7270/Q2XG9RGM |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50346139
(2-(4-(methylsulfonyl)phenyl)-3-phenethyl-1,3-thiaz...)Show InChI InChI=1S/C19H21NO3S2/c1-25(22,23)17-9-7-16(8-10-17)19-20(18(21)12-14-24-19)13-11-15-5-3-2-4-6-15/h2-10,19H,11-14H2,1H3 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shahid Beheshti University (M.C)
Curated by ChEMBL
| Assay Description Inhibition of ovine COX1 by chemiluminescent assay |
Bioorg Med Chem Lett 19: 3162-5 (2009)
Article DOI: 10.1016/j.bmcl.2009.04.125 BindingDB Entry DOI: 10.7270/Q2XG9RGM |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50346138
(3-benzyl-2-(4-(methylsulfonyl)phenyl)-1,3-thiazina...)Show InChI InChI=1S/C18H19NO3S2/c1-24(21,22)16-9-7-15(8-10-16)18-19(17(20)11-12-23-18)13-14-5-3-2-4-6-14/h2-10,18H,11-13H2,1H3 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.72E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shahid Beheshti University (M.C)
Curated by ChEMBL
| Assay Description Inhibition of ovine COX1 by chemiluminescent assay |
Bioorg Med Chem Lett 19: 3162-5 (2009)
Article DOI: 10.1016/j.bmcl.2009.04.125 BindingDB Entry DOI: 10.7270/Q2XG9RGM |
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 | 2.43E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shahid Beheshti University (M.C)
Curated by ChEMBL
| Assay Description Inhibition of ovine COX1 by chemiluminescent assay |
Bioorg Med Chem Lett 19: 3162-5 (2009)
Article DOI: 10.1016/j.bmcl.2009.04.125 BindingDB Entry DOI: 10.7270/Q2XG9RGM |
More data for this Ligand-Target Pair | |