Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 295.4 BDBM50085250

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 2 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))	BDBM50085250 (1-[2-(4-Benzyl-2-methyl-phenoxy)-ethyl]-pyrrolidin...) Show SMILES Cc1cc(Cc2ccccc2)ccc1OCCN1CCCC1 Show InChI InChI=1S/C20H25NO/c1-17-15-19(16-18-7-3-2-4-8-18)9-10-20(17)22-14-13-21-11-5-6-12-21/h2-4,7-10,15H,5-6,11-14,16H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	>3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Searle Research and Development Curated by ChEMBL					Assay Description Inhibitory activity was determined for LTB4 production in human whole blood.				J Med Chem 43: 721-35 (2000) BindingDB Entry DOI: 10.7270/Q2CN74MZ
					More data for this Ligand-Target Pair
Leukotriene A-4 hydrolase (Homo sapiens (Human))	BDBM50085250 (1-[2-(4-Benzyl-2-methyl-phenoxy)-ethyl]-pyrrolidin...) Show SMILES Cc1cc(Cc2ccccc2)ccc1OCCN1CCCC1 Show InChI InChI=1S/C20H25NO/c1-17-15-19(16-18-7-3-2-4-8-18)9-10-20(17)22-14-13-21-11-5-6-12-21/h2-4,7-10,15H,5-6,11-14,16H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	>3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Searle Research and Development Curated by ChEMBL					Assay Description Inhibitory activity was determined against Leukotriene A4 hydrolase				J Med Chem 43: 721-35 (2000) BindingDB Entry DOI: 10.7270/Q2CN74MZ
					More data for this Ligand-Target Pair