Found 5 hits in this display 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
(Homo sapiens (Human)) | BDBM50343924
(CHEMBL1775111 | N-Methyl-N-(2-(4-(2-(pyrrolidin-1-...)Show SMILES CN(c1ccccc1Oc1ccc(OCCN2CCCC2)cc1)S(C)(=O)=O Show InChI InChI=1S/C20H26N2O4S/c1-21(27(2,23)24)19-7-3-4-8-20(19)26-18-11-9-17(10-12-18)25-16-15-22-13-5-6-14-22/h3-4,7-12H,5-6,13-16H2,1-2H3 | 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 | 9.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description Inhibition of purified COX2 assessed as formation of oxidized TMPD during reduction og PGG2 to PGH2 preincubated for 15 mins by chromogenic assay |
J Med Chem 54: 3650-60 (2011)
Article DOI: 10.1021/jm200063s BindingDB Entry DOI: 10.7270/Q24M94WS |
More data for this Ligand-Target Pair | |
Leukotriene A-4 hydrolase
(Homo sapiens (Human)) | BDBM50343924
(CHEMBL1775111 | N-Methyl-N-(2-(4-(2-(pyrrolidin-1-...)Show SMILES CN(c1ccccc1Oc1ccc(OCCN2CCCC2)cc1)S(C)(=O)=O Show InChI InChI=1S/C20H26N2O4S/c1-21(27(2,23)24)19-7-3-4-8-20(19)26-18-11-9-17(10-12-18)25-16-15-22-13-5-6-14-22/h3-4,7-12H,5-6,13-16H2,1-2H3 | PDB MMDB
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 |
Peking University
Curated by ChEMBL
| Assay Description Inhibition of human LTA4 hydrolase activity assessed as LTB4 production after 15 mins by ELISA |
J Med Chem 54: 3650-60 (2011)
Article DOI: 10.1021/jm200063s BindingDB Entry DOI: 10.7270/Q24M94WS |
More data for this Ligand-Target Pair | |
Leukotriene A-4 hydrolase
(Homo sapiens (Human)) | BDBM50343924
(CHEMBL1775111 | N-Methyl-N-(2-(4-(2-(pyrrolidin-1-...)Show SMILES CN(c1ccccc1Oc1ccc(OCCN2CCCC2)cc1)S(C)(=O)=O Show InChI InChI=1S/C20H26N2O4S/c1-21(27(2,23)24)19-7-3-4-8-20(19)26-18-11-9-17(10-12-18)25-16-15-22-13-5-6-14-22/h3-4,7-12H,5-6,13-16H2,1-2H3 | PDB MMDB
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 |
Peking University
Curated by ChEMBL
| Assay Description Inhibition of human LTA4 hydrolase activity assessed as LTB4 production after 15 mins by ELISA |
J Med Chem 54: 3650-60 (2011)
Article DOI: 10.1021/jm200063s BindingDB Entry DOI: 10.7270/Q24M94WS |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50343924
(CHEMBL1775111 | N-Methyl-N-(2-(4-(2-(pyrrolidin-1-...)Show SMILES CN(c1ccccc1Oc1ccc(OCCN2CCCC2)cc1)S(C)(=O)=O Show InChI InChI=1S/C20H26N2O4S/c1-21(27(2,23)24)19-7-3-4-8-20(19)26-18-11-9-17(10-12-18)25-16-15-22-13-5-6-14-22/h3-4,7-12H,5-6,13-16H2,1-2H3 | 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 |
Peking University
Curated by ChEMBL
| Assay Description Inhibition of COX2 in human whole blood assessed as inhibition of LPS-induced PGE2 production after 24 hrs by ELISA |
J Med Chem 54: 3650-60 (2011)
Article DOI: 10.1021/jm200063s BindingDB Entry DOI: 10.7270/Q24M94WS |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Homo sapiens (Human)) | BDBM50343924
(CHEMBL1775111 | N-Methyl-N-(2-(4-(2-(pyrrolidin-1-...)Show SMILES CN(c1ccccc1Oc1ccc(OCCN2CCCC2)cc1)S(C)(=O)=O Show InChI InChI=1S/C20H26N2O4S/c1-21(27(2,23)24)19-7-3-4-8-20(19)26-18-11-9-17(10-12-18)25-16-15-22-13-5-6-14-22/h3-4,7-12H,5-6,13-16H2,1-2H3 | PDB
UniProtKB/SwissProt
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 |
Peking University
Curated by ChEMBL
| Assay Description Inhibition of purified COX1 assessed as formation of oxidized TMPD during reduction og PGG2 to PGH2 preincubated for 15 mins by chromogenic assay |
J Med Chem 54: 3650-60 (2011)
Article DOI: 10.1021/jm200063s BindingDB Entry DOI: 10.7270/Q24M94WS |
More data for this Ligand-Target Pair | |