Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Leukotriene A-4 hydrolase' and Ligand = 'BDBM50251399'   

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))	BDBM50251399 (4-((4-(methyl(2-oxo-2-(4-phenoxyphenylamino)ethyl)...) Show SMILES CN(CC(=O)Nc1ccc(Oc2ccccc2)cc1)C1CCN(Cc2ccc(cc2)C(O)=O)CC1 Show InChI InChI=1S/C28H31N3O4/c1-30(24-15-17-31(18-16-24)19-21-7-9-22(10-8-21)28(33)34)20-27(32)29-23-11-13-26(14-12-23)35-25-5-3-2-4-6-25/h2-14,24H,15-20H2,1H3,(H,29,32)(H,33,34)	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	60	n/a	n/a	n/a	n/a	n/a	n/a
Berlex Biosciences Curated by ChEMBL					Assay Description Inhibition of LTA4 hydrolase (unknown origin)				Bioorg Med Chem Lett 18: 3895-8 (2008) Article DOI: 10.1016/j.bmcl.2008.06.041 BindingDB Entry DOI: 10.7270/Q2GQ6XK8
					More data for this Ligand-Target Pair
Leukotriene A-4 hydrolase (Homo sapiens (Human))	BDBM50251399 (4-((4-(methyl(2-oxo-2-(4-phenoxyphenylamino)ethyl)...) Show SMILES CN(CC(=O)Nc1ccc(Oc2ccccc2)cc1)C1CCN(Cc2ccc(cc2)C(O)=O)CC1 Show InChI InChI=1S/C28H31N3O4/c1-30(24-15-17-31(18-16-24)19-21-7-9-22(10-8-21)28(33)34)20-27(32)29-23-11-13-26(14-12-23)35-25-5-3-2-4-6-25/h2-14,24H,15-20H2,1H3,(H,29,32)(H,33,34)	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	60	n/a	n/a	n/a	n/a	n/a	n/a
Berlex Biosciences Curated by ChEMBL					Assay Description Inhibition of LTA4 hydrolase (unknown origin) by hydrolase assay				Bioorg Med Chem Lett 18: 3891-4 (2008) Article DOI: 10.1016/j.bmcl.2008.06.046 BindingDB Entry DOI: 10.7270/Q20P0ZTV
					More data for this Ligand-Target Pair
Leukotriene A-4 hydrolase (Homo sapiens (Human))	BDBM50251399 (4-((4-(methyl(2-oxo-2-(4-phenoxyphenylamino)ethyl)...) Show SMILES CN(CC(=O)Nc1ccc(Oc2ccccc2)cc1)C1CCN(Cc2ccc(cc2)C(O)=O)CC1 Show InChI InChI=1S/C28H31N3O4/c1-30(24-15-17-31(18-16-24)19-21-7-9-22(10-8-21)28(33)34)20-27(32)29-23-11-13-26(14-12-23)35-25-5-3-2-4-6-25/h2-14,24H,15-20H2,1H3,(H,29,32)(H,33,34)	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	270	n/a	n/a	n/a	n/a	n/a	n/a
Berlex Biosciences Curated by ChEMBL					Assay Description Inhibition of LTA4 hydrolase in human whole blood				Bioorg Med Chem Lett 18: 3895-8 (2008) Article DOI: 10.1016/j.bmcl.2008.06.041 BindingDB Entry DOI: 10.7270/Q2GQ6XK8
					More data for this Ligand-Target Pair
Leukotriene A-4 hydrolase (Homo sapiens (Human))	BDBM50251399 (4-((4-(methyl(2-oxo-2-(4-phenoxyphenylamino)ethyl)...) Show SMILES CN(CC(=O)Nc1ccc(Oc2ccccc2)cc1)C1CCN(Cc2ccc(cc2)C(O)=O)CC1 Show InChI InChI=1S/C28H31N3O4/c1-30(24-15-17-31(18-16-24)19-21-7-9-22(10-8-21)28(33)34)20-27(32)29-23-11-13-26(14-12-23)35-25-5-3-2-4-6-25/h2-14,24H,15-20H2,1H3,(H,29,32)(H,33,34)	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	270	n/a	n/a	n/a	n/a	n/a	n/a
Berlex Biosciences Curated by ChEMBL					Assay Description Inhibition of LTA4 hydrolase (unknown origin) by whole blood assay				Bioorg Med Chem Lett 18: 3891-4 (2008) Article DOI: 10.1016/j.bmcl.2008.06.046 BindingDB Entry DOI: 10.7270/Q20P0ZTV
					More data for this Ligand-Target Pair