BDBM50085257 1-[2-(4-Phenylmethanesulfonyl-phenoxy)-ethyl]-pyrrolidine::CHEMBL162966

SMILES: O=S(=O)(Cc1ccccc1)c1ccc(OCCN2CCCC2)cc1

InChI Key: InChIKey=GOKXASBQBXHYEK-UHFFFAOYSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50085257   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Leukotriene A4 hydrolase (Homo sapiens (Human))	BDBM50085257 (1-[2-(4-Phenylmethanesulfonyl-phenoxy)-ethyl]-pyrr...) Show SMILES O=S(=O)(Cc1ccccc1)c1ccc(OCCN2CCCC2)cc1 Show InChI InChI=1S/C19H23NO3S/c21-24(22,16-17-6-2-1-3-7-17)19-10-8-18(9-11-19)23-15-14-20-12-4-5-13-20/h1-3,6-11H,4-5,12-16H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gyeongsang National University (GNU) Curated by ChEMBL					Assay Description Inhibition of human leukotriene A4 hydrolase				Eur J Med Chem 46: 1593-603 (2011) Article DOI: 10.1016/j.ejmech.2011.02.007 BindingDB Entry DOI: 10.7270/Q2K64JDG
					More data for this Ligand-Target Pair
Leukotriene A4 hydrolase (Homo sapiens (Human))	BDBM50085257 (1-[2-(4-Phenylmethanesulfonyl-phenoxy)-ethyl]-pyrr...) Show SMILES O=S(=O)(Cc1ccccc1)c1ccc(OCCN2CCCC2)cc1 Show InChI InChI=1S/C19H23NO3S/c21-24(22,16-17-6-2-1-3-7-17)19-10-8-18(9-11-19)23-15-14-20-12-4-5-13-20/h1-3,6-11H,4-5,12-16H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	7.70E+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 A4 hydrolase (Homo sapiens (Human))	BDBM50085257 (1-[2-(4-Phenylmethanesulfonyl-phenoxy)-ethyl]-pyrr...) Show SMILES O=S(=O)(Cc1ccccc1)c1ccc(OCCN2CCCC2)cc1 Show InChI InChI=1S/C19H23NO3S/c21-24(22,16-17-6-2-1-3-7-17)19-10-8-18(9-11-19)23-15-14-20-12-4-5-13-20/h1-3,6-11H,4-5,12-16H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.00E+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