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 |
Leukotriene A-4 hydrolase
(Homo sapiens (Human)) | BDBM50343927
(1-(2-(4-(4-Nitrophenoxy)phenoxy)ethyl)pyrrolidine ...)Show SMILES [O-][N+](=O)c1ccc(Oc2ccc(OCCN3CCCC3)cc2)cc1 Show InChI InChI=1S/C18H20N2O4/c21-20(22)15-3-5-17(6-4-15)24-18-9-7-16(8-10-18)23-14-13-19-11-1-2-12-19/h3-10H,1-2,11-14H2 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 370 | 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)) | BDBM50343927
(1-(2-(4-(4-Nitrophenoxy)phenoxy)ethyl)pyrrolidine ...)Show SMILES [O-][N+](=O)c1ccc(Oc2ccc(OCCN3CCCC3)cc2)cc1 Show InChI InChI=1S/C18H20N2O4/c21-20(22)15-3-5-17(6-4-15)24-18-9-7-16(8-10-18)23-14-13-19-11-1-2-12-19/h3-10H,1-2,11-14H2 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 690 | 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 1
(Homo sapiens (Human)) | BDBM50343927
(1-(2-(4-(4-Nitrophenoxy)phenoxy)ethyl)pyrrolidine ...)Show SMILES [O-][N+](=O)c1ccc(Oc2ccc(OCCN3CCCC3)cc2)cc1 Show InChI InChI=1S/C18H20N2O4/c21-20(22)15-3-5-17(6-4-15)24-18-9-7-16(8-10-18)23-14-13-19-11-1-2-12-19/h3-10H,1-2,11-14H2 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 2.04E+4 | 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 | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50343927
(1-(2-(4-(4-Nitrophenoxy)phenoxy)ethyl)pyrrolidine ...)Show SMILES [O-][N+](=O)c1ccc(Oc2ccc(OCCN3CCCC3)cc2)cc1 Show InChI InChI=1S/C18H20N2O4/c21-20(22)15-3-5-17(6-4-15)24-18-9-7-16(8-10-18)23-14-13-19-11-1-2-12-19/h3-10H,1-2,11-14H2 | 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 | 3.53E+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 | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50343927
(1-(2-(4-(4-Nitrophenoxy)phenoxy)ethyl)pyrrolidine ...)Show SMILES [O-][N+](=O)c1ccc(Oc2ccc(OCCN3CCCC3)cc2)cc1 Show InChI InChI=1S/C18H20N2O4/c21-20(22)15-3-5-17(6-4-15)24-18-9-7-16(8-10-18)23-14-13-19-11-1-2-12-19/h3-10H,1-2,11-14H2 | 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+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 | |