Found 14 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 1
(Ovis aries (Sheep)) | BDBM17638
(2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl...)Show SMILES COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1 Show InChI InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23) | 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 | 600 | n/a | n/a | n/a | n/a | n/a | n/a |
Minia University
Curated by ChEMBL
| Assay Description Inhibition of ovine COX1 assessed as prostaglandin F2alpha level |
Eur J Med Chem 77: 155-65 (2014)
Article DOI: 10.1016/j.ejmech.2014.03.001 BindingDB Entry DOI: 10.7270/Q2M32X8R |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50029593
(CHEMBL7162 | N-(2-(cyclohexyloxy)-4-nitrophenyl)me...)Show InChI InChI=1S/C13H18N2O5S/c1-21(18,19)14-12-8-7-10(15(16)17)9-13(12)20-11-5-3-2-4-6-11/h7-9,11,14H,2-6H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE MMDB PC cid PC sid PDB UniChem
Patents
Similars
| PDB Article PubMed
| n/a | n/a | 2.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Minia University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant COX2 assessed as prostaglandin F2alpha level |
Eur J Med Chem 77: 155-65 (2014)
Article DOI: 10.1016/j.ejmech.2014.03.001 BindingDB Entry DOI: 10.7270/Q2M32X8R |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM17638
(2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl...)Show SMILES COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1 Show InChI InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23) | 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 | 1.85E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Minia University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant COX2 assessed as prostaglandin F2alpha level |
Eur J Med Chem 77: 155-65 (2014)
Article DOI: 10.1016/j.ejmech.2014.03.001 BindingDB Entry DOI: 10.7270/Q2M32X8R |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50001297
(CHEMBL3237075)Show SMILES COc1ccc(cc1)-n1nc(nc1-c1cc(OC)c(OC)c(OC)c1)C(=O)NN Show InChI InChI=1S/C19H21N5O5/c1-26-13-7-5-12(6-8-13)24-18(21-17(23-24)19(25)22-20)11-9-14(27-2)16(29-4)15(10-11)28-3/h5-10H,20H2,1-4H3,(H,22,25) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 3.98E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Minia University
Curated by ChEMBL
| Assay Description Inhibition of ovine COX1 assessed as prostaglandin F2alpha level |
Eur J Med Chem 77: 155-65 (2014)
Article DOI: 10.1016/j.ejmech.2014.03.001 BindingDB Entry DOI: 10.7270/Q2M32X8R |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50001252
(CHEMBL3236777)Show SMILES CNC(=O)c1nc(-c2cc(OC)c(OC)c(OC)c2)n(n1)-c1ccc(OC)cc1 Show InChI InChI=1S/C20H22N4O5/c1-21-20(25)18-22-19(24(23-18)13-6-8-14(26-2)9-7-13)12-10-15(27-3)17(29-5)16(11-12)28-4/h6-11H,1-5H3,(H,21,25) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 4.59E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Minia University
Curated by ChEMBL
| Assay Description Inhibition of ovine COX1 assessed as prostaglandin F2alpha level |
Eur J Med Chem 77: 155-65 (2014)
Article DOI: 10.1016/j.ejmech.2014.03.001 BindingDB Entry DOI: 10.7270/Q2M32X8R |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50001297
(CHEMBL3237075)Show SMILES COc1ccc(cc1)-n1nc(nc1-c1cc(OC)c(OC)c(OC)c1)C(=O)NN Show InChI InChI=1S/C19H21N5O5/c1-26-13-7-5-12(6-8-13)24-18(21-17(23-24)19(25)22-20)11-9-14(27-2)16(29-4)15(10-11)28-3/h5-10H,20H2,1-4H3,(H,22,25) | 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 | 4.63E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Minia University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant COX2 assessed as prostaglandin F2alpha level |
Eur J Med Chem 77: 155-65 (2014)
Article DOI: 10.1016/j.ejmech.2014.03.001 BindingDB Entry DOI: 10.7270/Q2M32X8R |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50001252
(CHEMBL3236777)Show SMILES CNC(=O)c1nc(-c2cc(OC)c(OC)c(OC)c2)n(n1)-c1ccc(OC)cc1 Show InChI InChI=1S/C20H22N4O5/c1-21-20(25)18-22-19(24(23-18)13-6-8-14(26-2)9-7-13)12-10-15(27-3)17(29-5)16(11-12)28-4/h6-11H,1-5H3,(H,21,25) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 6.82E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Minia University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant COX2 assessed as prostaglandin F2alpha level |
Eur J Med Chem 77: 155-65 (2014)
Article DOI: 10.1016/j.ejmech.2014.03.001 BindingDB Entry DOI: 10.7270/Q2M32X8R |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50001261
(CHEMBL3237067)Show SMILES COc1ccc(cc1)-n1nc(nc1-c1cc(OC)c(OC)c(OC)c1)C(=O)Nc1ccc(Br)cc1 Show InChI InChI=1S/C25H23BrN4O5/c1-32-19-11-9-18(10-12-19)30-24(15-13-20(33-2)22(35-4)21(14-15)34-3)28-23(29-30)25(31)27-17-7-5-16(26)6-8-17/h5-14H,1-4H3,(H,27,31) | PDB
KEGG
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 |
Minia University
Curated by ChEMBL
| Assay Description Inhibition of ovine COX1 assessed as prostaglandin F2alpha level |
Eur J Med Chem 77: 155-65 (2014)
Article DOI: 10.1016/j.ejmech.2014.03.001 BindingDB Entry DOI: 10.7270/Q2M32X8R |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50001294
(CHEMBL3237071)Show SMILES COc1ccc(cc1)-n1nc(nc1-c1cc(OC)c(OC)c(OC)c1)C(=O)Nc1ccc(OC)c(OC)c1 Show InChI InChI=1S/C27H28N4O7/c1-33-19-10-8-18(9-11-19)31-26(16-13-22(36-4)24(38-6)23(14-16)37-5)29-25(30-31)27(32)28-17-7-12-20(34-2)21(15-17)35-3/h7-15H,1-6H3,(H,28,32) | 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 | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Minia University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant COX2 assessed as prostaglandin F2alpha level |
Eur J Med Chem 77: 155-65 (2014)
Article DOI: 10.1016/j.ejmech.2014.03.001 BindingDB Entry DOI: 10.7270/Q2M32X8R |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50001292
(CHEMBL3237068)Show SMILES COc1ccc(cc1)-n1nc(nc1-c1cc(OC)c(OC)c(OC)c1)C(=O)Nc1ccc(Cl)cc1 Show InChI InChI=1S/C25H23ClN4O5/c1-32-19-11-9-18(10-12-19)30-24(15-13-20(33-2)22(35-4)21(14-15)34-3)28-23(29-30)25(31)27-17-7-5-16(26)6-8-17/h5-14H,1-4H3,(H,27,31) | 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 | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Minia University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant COX2 assessed as prostaglandin F2alpha level |
Eur J Med Chem 77: 155-65 (2014)
Article DOI: 10.1016/j.ejmech.2014.03.001 BindingDB Entry DOI: 10.7270/Q2M32X8R |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50001292
(CHEMBL3237068)Show SMILES COc1ccc(cc1)-n1nc(nc1-c1cc(OC)c(OC)c(OC)c1)C(=O)Nc1ccc(Cl)cc1 Show InChI InChI=1S/C25H23ClN4O5/c1-32-19-11-9-18(10-12-19)30-24(15-13-20(33-2)22(35-4)21(14-15)34-3)28-23(29-30)25(31)27-17-7-5-16(26)6-8-17/h5-14H,1-4H3,(H,27,31) | PDB
KEGG
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 |
Minia University
Curated by ChEMBL
| Assay Description Inhibition of ovine COX1 assessed as prostaglandin F2alpha level |
Eur J Med Chem 77: 155-65 (2014)
Article DOI: 10.1016/j.ejmech.2014.03.001 BindingDB Entry DOI: 10.7270/Q2M32X8R |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50001294
(CHEMBL3237071)Show SMILES COc1ccc(cc1)-n1nc(nc1-c1cc(OC)c(OC)c(OC)c1)C(=O)Nc1ccc(OC)c(OC)c1 Show InChI InChI=1S/C27H28N4O7/c1-33-19-10-8-18(9-11-19)31-26(16-13-22(36-4)24(38-6)23(14-16)37-5)29-25(30-31)27(32)28-17-7-12-20(34-2)21(15-17)35-3/h7-15H,1-6H3,(H,28,32) | PDB
KEGG
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 |
Minia University
Curated by ChEMBL
| Assay Description Inhibition of ovine COX1 assessed as prostaglandin F2alpha level |
Eur J Med Chem 77: 155-65 (2014)
Article DOI: 10.1016/j.ejmech.2014.03.001 BindingDB Entry DOI: 10.7270/Q2M32X8R |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50001261
(CHEMBL3237067)Show SMILES COc1ccc(cc1)-n1nc(nc1-c1cc(OC)c(OC)c(OC)c1)C(=O)Nc1ccc(Br)cc1 Show InChI InChI=1S/C25H23BrN4O5/c1-32-19-11-9-18(10-12-19)30-24(15-13-20(33-2)22(35-4)21(14-15)34-3)28-23(29-30)25(31)27-17-7-5-16(26)6-8-17/h5-14H,1-4H3,(H,27,31) | 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 | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Minia University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant COX2 assessed as prostaglandin F2alpha level |
Eur J Med Chem 77: 155-65 (2014)
Article DOI: 10.1016/j.ejmech.2014.03.001 BindingDB Entry DOI: 10.7270/Q2M32X8R |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50029593
(CHEMBL7162 | N-(2-(cyclohexyloxy)-4-nitrophenyl)me...)Show InChI InChI=1S/C13H18N2O5S/c1-21(18,19)14-12-8-7-10(15(16)17)9-13(12)20-11-5-3-2-4-6-11/h7-9,11,14H,2-6H2,1H3 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
CHEMBL MCE MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 2.13E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Minia University
Curated by ChEMBL
| Assay Description Inhibition of ovine COX1 assessed as prostaglandin F2alpha level |
Eur J Med Chem 77: 155-65 (2014)
Article DOI: 10.1016/j.ejmech.2014.03.001 BindingDB Entry DOI: 10.7270/Q2M32X8R |
More data for this Ligand-Target Pair | |