Found 12 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
(Mus musculus (Mouse)) | BDBM22966
(2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl...)Show SMILES COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(=O)NCCc3ccccc3)c2c1 Show InChI InChI=1S/C27H25ClN2O3/c1-18-23(17-26(31)29-15-14-19-6-4-3-5-7-19)24-16-22(33-2)12-13-25(24)30(18)27(32)20-8-10-21(28)11-9-20/h3-13,16H,14-15,17H2,1-2H3,(H,29,31) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
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| Article PubMed
| n/a | n/a | 210 | n/a | n/a | n/a | n/a | n/a | n/a |
National Taiwan University
Curated by ChEMBL
| Assay Description Inhibition of COX2 in mouse RAW264.7 cells by enzyme immunoassay |
Bioorg Med Chem 18: 597-604 (2010)
Article DOI: 10.1016/j.bmc.2009.12.008 BindingDB Entry DOI: 10.7270/Q2RF5V4Z |
More data for this Ligand-Target Pair | |
Polyunsaturated fatty acid 5-lipoxygenase
(Homo sapiens (Human)) | BDBM50310340
(3-(4-bromophenyl)-5-nitrobenzo[1.3.2]dithiazolium-...)Show SMILES [O-][N+](=O)c1ccc2c(c1)S(=NS2(=O)=O)c1ccc(Br)cc1 |c:10| Show InChI InChI=1S/C12H7BrN2O4S2/c13-8-1-4-10(5-2-8)20-11-7-9(15(16)17)3-6-12(11)21(18,19)14-20/h1-7H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
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CHEMBL PC cid PC sid UniChem
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| Article PubMed
| n/a | n/a | 470 | n/a | n/a | n/a | n/a | n/a | n/a |
National Taiwan University
Curated by ChEMBL
| Assay Description Inhibition of LOX5 in human PMBL by enzyme immunoassay |
Bioorg Med Chem 18: 597-604 (2010)
Article DOI: 10.1016/j.bmc.2009.12.008 BindingDB Entry DOI: 10.7270/Q2RF5V4Z |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | 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
UniProtKB/SwissProt
GoogleScholar AffyNet
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CHEMBL MCE MMDB PC cid PC sid PDB UniChem
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| PDB Article PubMed
| n/a | n/a | 810 | n/a | n/a | n/a | n/a | n/a | n/a |
National Taiwan University
Curated by ChEMBL
| Assay Description Inhibition of COX2 in mouse RAW264.7 cells by enzyme immunoassay |
Bioorg Med Chem 18: 597-604 (2010)
Article DOI: 10.1016/j.bmc.2009.12.008 BindingDB Entry DOI: 10.7270/Q2RF5V4Z |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Polyunsaturated fatty acid 5-lipoxygenase
(Homo sapiens (Human)) | BDBM50310339
(3-(4-bromophenyl)-6-nitrobenzo[1.3.2]dithiazolium-...)Show SMILES [O-][N+](=O)c1ccc2c(c1)S(=O)(=O)N=S2c1ccc(Br)cc1 |c:13| Show InChI InChI=1S/C12H7BrN2O4S2/c13-8-1-4-10(5-2-8)20-11-6-3-9(15(16)17)7-12(11)21(18,19)14-20/h1-7H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 1.22E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
National Taiwan University
Curated by ChEMBL
| Assay Description Inhibition of LOX5 in human PMBL by enzyme immunoassay |
Bioorg Med Chem 18: 597-604 (2010)
Article DOI: 10.1016/j.bmc.2009.12.008 BindingDB Entry DOI: 10.7270/Q2RF5V4Z |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Mus musculus) | BDBM50310340
(3-(4-bromophenyl)-5-nitrobenzo[1.3.2]dithiazolium-...)Show SMILES [O-][N+](=O)c1ccc2c(c1)S(=NS2(=O)=O)c1ccc(Br)cc1 |c:10| Show InChI InChI=1S/C12H7BrN2O4S2/c13-8-1-4-10(5-2-8)20-11-7-9(15(16)17)3-6-12(11)21(18,19)14-20/h1-7H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
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CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
National Taiwan University
Curated by ChEMBL
| Assay Description Inhibition of COX1 in mouse RAW264.7 cells by enzyme immunoassay |
Bioorg Med Chem 18: 597-604 (2010)
Article DOI: 10.1016/j.bmc.2009.12.008 BindingDB Entry DOI: 10.7270/Q2RF5V4Z |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50310339
(3-(4-bromophenyl)-6-nitrobenzo[1.3.2]dithiazolium-...)Show SMILES [O-][N+](=O)c1ccc2c(c1)S(=O)(=O)N=S2c1ccc(Br)cc1 |c:13| Show InChI InChI=1S/C12H7BrN2O4S2/c13-8-1-4-10(5-2-8)20-11-6-3-9(15(16)17)7-12(11)21(18,19)14-20/h1-7H | 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 | 1.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
National Taiwan University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant COX2 expressed in insect Sf9 cells by enzyme immunoassay |
Bioorg Med Chem 18: 597-604 (2010)
Article DOI: 10.1016/j.bmc.2009.12.008 BindingDB Entry DOI: 10.7270/Q2RF5V4Z |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Mus musculus) | BDBM50310339
(3-(4-bromophenyl)-6-nitrobenzo[1.3.2]dithiazolium-...)Show SMILES [O-][N+](=O)c1ccc2c(c1)S(=O)(=O)N=S2c1ccc(Br)cc1 |c:13| Show InChI InChI=1S/C12H7BrN2O4S2/c13-8-1-4-10(5-2-8)20-11-6-3-9(15(16)17)7-12(11)21(18,19)14-20/h1-7H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 2.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
National Taiwan University
Curated by ChEMBL
| Assay Description Inhibition of COX1 in mouse RAW264.7 cells by enzyme immunoassay |
Bioorg Med Chem 18: 597-604 (2010)
Article DOI: 10.1016/j.bmc.2009.12.008 BindingDB Entry DOI: 10.7270/Q2RF5V4Z |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50310339
(3-(4-bromophenyl)-6-nitrobenzo[1.3.2]dithiazolium-...)Show SMILES [O-][N+](=O)c1ccc2c(c1)S(=O)(=O)N=S2c1ccc(Br)cc1 |c:13| Show InChI InChI=1S/C12H7BrN2O4S2/c13-8-1-4-10(5-2-8)20-11-6-3-9(15(16)17)7-12(11)21(18,19)14-20/h1-7H | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 4.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
National Taiwan University
Curated by ChEMBL
| Assay Description Inhibition of COX2 in mouse RAW264.7 cells by enzyme immunoassay |
Bioorg Med Chem 18: 597-604 (2010)
Article DOI: 10.1016/j.bmc.2009.12.008 BindingDB Entry DOI: 10.7270/Q2RF5V4Z |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50310339
(3-(4-bromophenyl)-6-nitrobenzo[1.3.2]dithiazolium-...)Show SMILES [O-][N+](=O)c1ccc2c(c1)S(=O)(=O)N=S2c1ccc(Br)cc1 |c:13| Show InChI InChI=1S/C12H7BrN2O4S2/c13-8-1-4-10(5-2-8)20-11-6-3-9(15(16)17)7-12(11)21(18,19)14-20/h1-7H | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 6.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
National Taiwan University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant COX1 in human platelets by enzyme immunoassay |
Bioorg Med Chem 18: 597-604 (2010)
Article DOI: 10.1016/j.bmc.2009.12.008 BindingDB Entry DOI: 10.7270/Q2RF5V4Z |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Mus musculus (Mouse)) | BDBM50310340
(3-(4-bromophenyl)-5-nitrobenzo[1.3.2]dithiazolium-...)Show SMILES [O-][N+](=O)c1ccc2c(c1)S(=NS2(=O)=O)c1ccc(Br)cc1 |c:10| Show InChI InChI=1S/C12H7BrN2O4S2/c13-8-1-4-10(5-2-8)20-11-7-9(15(16)17)3-6-12(11)21(18,19)14-20/h1-7H | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.81E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
National Taiwan University
Curated by ChEMBL
| Assay Description Inhibition of COX2 in mouse RAW264.7 cells by enzyme immunoassay |
Bioorg Med Chem 18: 597-604 (2010)
Article DOI: 10.1016/j.bmc.2009.12.008 BindingDB Entry DOI: 10.7270/Q2RF5V4Z |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Mus musculus) | BDBM22966
(2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl...)Show SMILES COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(=O)NCCc3ccccc3)c2c1 Show InChI InChI=1S/C27H25ClN2O3/c1-18-23(17-26(31)29-15-14-19-6-4-3-5-7-19)24-16-22(33-2)12-13-25(24)30(18)27(32)20-8-10-21(28)11-9-20/h3-13,16H,14-15,17H2,1-2H3,(H,29,31) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 5.67E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
National Taiwan University
Curated by ChEMBL
| Assay Description Inhibition of COX1 in mouse RAW264.7 cells by enzyme immunoassay |
Bioorg Med Chem 18: 597-604 (2010)
Article DOI: 10.1016/j.bmc.2009.12.008 BindingDB Entry DOI: 10.7270/Q2RF5V4Z |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Mus musculus) | 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
Reactome pathway 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 | 6.37E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
National Taiwan University
Curated by ChEMBL
| Assay Description Inhibition of COX1 in mouse RAW264.7 cells by enzyme immunoassay |
Bioorg Med Chem 18: 597-604 (2010)
Article DOI: 10.1016/j.bmc.2009.12.008 BindingDB Entry DOI: 10.7270/Q2RF5V4Z |
More data for this Ligand-Target Pair | |