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
(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
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
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CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Karachi
Curated by ChEMBL
| Assay Description Inhibition of COX1 |
Eur J Med Chem 45: 4058-64 (2010)
Article DOI: 10.1016/j.ejmech.2010.05.065 BindingDB Entry DOI: 10.7270/Q2GQ6ZQG |
More data for this Ligand-Target Pair | |
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 | 670 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Karachi
Curated by ChEMBL
| Assay Description Inhibition of COX2 |
Eur J Med Chem 45: 4058-64 (2010)
Article DOI: 10.1016/j.ejmech.2010.05.065 BindingDB Entry DOI: 10.7270/Q2GQ6ZQG |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50326126
(((m-tolylimino)methyl)-4H-chromen-4-one | 3-{[(3-M...)Show InChI InChI=1S/C17H13NO2/c1-12-5-4-6-14(9-12)18-10-13-11-20-16-8-3-2-7-15(16)17(13)19/h2-11H,1H3/b18-10+ | 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 | 2.54E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Karachi
Curated by ChEMBL
| Assay Description Inhibition of COX2 |
Eur J Med Chem 45: 4058-64 (2010)
Article DOI: 10.1016/j.ejmech.2010.05.065 BindingDB Entry DOI: 10.7270/Q2GQ6ZQG |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50326124
((E)-2-((4-oxo-4H-chromen-3-yl)methyleneamino)benzo...)Show InChI InChI=1S/C17H11NO4/c19-16-11(10-22-15-8-4-2-6-13(15)16)9-18-14-7-3-1-5-12(14)17(20)21/h1-10H,(H,20,21)/b18-9+ | 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 | 6.57E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Karachi
Curated by ChEMBL
| Assay Description Inhibition of COX2 |
Eur J Med Chem 45: 4058-64 (2010)
Article DOI: 10.1016/j.ejmech.2010.05.065 BindingDB Entry DOI: 10.7270/Q2GQ6ZQG |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50326127
(4-methyl-N'-((4-oxo-4H-chromen-3-yl)methylene)benz...)Show SMILES Cc1ccc(cc1)S(=O)(=O)NN=Cc1coc2ccccc2c1=O |w:12.13| Show InChI InChI=1S/C17H14N2O4S/c1-12-6-8-14(9-7-12)24(21,22)19-18-10-13-11-23-16-5-3-2-4-15(16)17(13)20/h2-11,19H,1H3 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.50E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Karachi
Curated by ChEMBL
| Assay Description Inhibition of COX1 |
Eur J Med Chem 45: 4058-64 (2010)
Article DOI: 10.1016/j.ejmech.2010.05.065 BindingDB Entry DOI: 10.7270/Q2GQ6ZQG |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50326127
(4-methyl-N'-((4-oxo-4H-chromen-3-yl)methylene)benz...)Show SMILES Cc1ccc(cc1)S(=O)(=O)NN=Cc1coc2ccccc2c1=O |w:12.13| Show InChI InChI=1S/C17H14N2O4S/c1-12-6-8-14(9-7-12)24(21,22)19-18-10-13-11-23-16-5-3-2-4-15(16)17(13)20/h2-11,19H,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.04E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Karachi
Curated by ChEMBL
| Assay Description Inhibition of COX2 |
Eur J Med Chem 45: 4058-64 (2010)
Article DOI: 10.1016/j.ejmech.2010.05.065 BindingDB Entry DOI: 10.7270/Q2GQ6ZQG |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50326128
(CHEMBL1241822 | N'-((4-oxo-4H-chromen-3-yl)methyle...)Show InChI InChI=1S/C17H12N2O3/c20-16-13(11-22-15-9-5-4-8-14(15)16)10-18-19-17(21)12-6-2-1-3-7-12/h1-11H,(H,19,21) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 4.06E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Karachi
Curated by ChEMBL
| Assay Description Inhibition of COX1 |
Eur J Med Chem 45: 4058-64 (2010)
Article DOI: 10.1016/j.ejmech.2010.05.065 BindingDB Entry DOI: 10.7270/Q2GQ6ZQG |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM22360
(2-(acetyloxy)benzoate | 2-(acetyloxy)benzoic acid ...)Show InChI InChI=1S/C9H8O4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3,(H,11,12) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| Purchase
DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 7.50E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Karachi
Curated by ChEMBL
| Assay Description Inhibition of COX1 |
Eur J Med Chem 45: 4058-64 (2010)
Article DOI: 10.1016/j.ejmech.2010.05.065 BindingDB Entry DOI: 10.7270/Q2GQ6ZQG |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50326128
(CHEMBL1241822 | N'-((4-oxo-4H-chromen-3-yl)methyle...)Show InChI InChI=1S/C17H12N2O3/c20-16-13(11-22-15-9-5-4-8-14(15)16)10-18-19-17(21)12-6-2-1-3-7-12/h1-11H,(H,19,21) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 8.02E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Karachi
Curated by ChEMBL
| Assay Description Inhibition of COX2 |
Eur J Med Chem 45: 4058-64 (2010)
Article DOI: 10.1016/j.ejmech.2010.05.065 BindingDB Entry DOI: 10.7270/Q2GQ6ZQG |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM22360
(2-(acetyloxy)benzoate | 2-(acetyloxy)benzoic acid ...)Show InChI InChI=1S/C9H8O4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3,(H,11,12) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| DrugBank Article PubMed
| n/a | n/a | 1.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Karachi
Curated by ChEMBL
| Assay Description Inhibition of COX2 |
Eur J Med Chem 45: 4058-64 (2010)
Article DOI: 10.1016/j.ejmech.2010.05.065 BindingDB Entry DOI: 10.7270/Q2GQ6ZQG |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50326125
(CHEMBL1240658 | N'-((4-oxo-4H-chromen-3-yl)methyle...)Show InChI InChI=1S/C14H14N2O3/c1-2-5-13(17)16-15-8-10-9-19-12-7-4-3-6-11(12)14(10)18/h3-4,6-9H,2,5H2,1H3,(H,16,17) | 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 | >1.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Karachi
Curated by ChEMBL
| Assay Description Inhibition of COX2 |
Eur J Med Chem 45: 4058-64 (2010)
Article DOI: 10.1016/j.ejmech.2010.05.065 BindingDB Entry DOI: 10.7270/Q2GQ6ZQG |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50326125
(CHEMBL1240658 | N'-((4-oxo-4H-chromen-3-yl)methyle...)Show InChI InChI=1S/C14H14N2O3/c1-2-5-13(17)16-15-8-10-9-19-12-7-4-3-6-11(12)14(10)18/h3-4,6-9H,2,5H2,1H3,(H,16,17) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | >1.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Karachi
Curated by ChEMBL
| Assay Description Inhibition of COX1 |
Eur J Med Chem 45: 4058-64 (2010)
Article DOI: 10.1016/j.ejmech.2010.05.065 BindingDB Entry DOI: 10.7270/Q2GQ6ZQG |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50326124
((E)-2-((4-oxo-4H-chromen-3-yl)methyleneamino)benzo...)Show InChI InChI=1S/C17H11NO4/c19-16-11(10-22-15-8-4-2-6-13(15)16)9-18-14-7-3-1-5-12(14)17(20)21/h1-10H,(H,20,21)/b18-9+ | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | >1.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Karachi
Curated by ChEMBL
| Assay Description Inhibition of COX1 |
Eur J Med Chem 45: 4058-64 (2010)
Article DOI: 10.1016/j.ejmech.2010.05.065 BindingDB Entry DOI: 10.7270/Q2GQ6ZQG |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50326126
(((m-tolylimino)methyl)-4H-chromen-4-one | 3-{[(3-M...)Show InChI InChI=1S/C17H13NO2/c1-12-5-4-6-14(9-12)18-10-13-11-20-16-8-3-2-7-15(16)17(13)19/h2-11H,1H3/b18-10+ | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 1.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Karachi
Curated by ChEMBL
| Assay Description Inhibition of COX1 |
Eur J Med Chem 45: 4058-64 (2010)
Article DOI: 10.1016/j.ejmech.2010.05.065 BindingDB Entry DOI: 10.7270/Q2GQ6ZQG |
More data for this Ligand-Target Pair | |