BDBM50015191 CHEMBL11944::N-[4-(2-Hydroxy-3-{2-[4-(2-methyl-imidazol-1-yl)-phenoxy]-ethylamino}-propoxy)-phenyl]-N-methyl-methanesulfonamide

SMILES: CN(c1ccc(OCC(O)CNCCOc2ccc(cc2)-n2ccnc2C)cc1)S(C)(=O)=O

InChI Key: InChIKey=UMGITWPLWLKFLA-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50015191   

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
Beta-1 adrenergic receptor (Homo sapiens (Human))	BDBM50015191 (CHEMBL11944 | N-[4-(2-Hydroxy-3-{2-[4-(2-methyl-im...) Show SMILES CN(c1ccc(OCC(O)CNCCOc2ccc(cc2)-n2ccnc2C)cc1)S(C)(=O)=O Show InChI InChI=1S/C23H30N4O5S/c1-18-25-12-14-27(18)20-6-10-22(11-7-20)31-15-13-24-16-21(28)17-32-23-8-4-19(5-9-23)26(2)33(3,29)30/h4-12,14,21,24,28H,13,15-17H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Berlex Laboratories Curated by ChEMBL					Assay Description In vitro Beta-1 adrenergic receptor affinity in partially purified membrane fractions from canine cardiac tissue using [SH]dihydroalprenolol (4.5 nM)				J Med Chem 33: 1087-90 (1990) BindingDB Entry DOI: 10.7270/Q2DB82FG
					More data for this Ligand-Target Pair
Beta-2 adrenergic receptor (Canis familiaris)	BDBM50015191 (CHEMBL11944 | N-[4-(2-Hydroxy-3-{2-[4-(2-methyl-im...) Show SMILES CN(c1ccc(OCC(O)CNCCOc2ccc(cc2)-n2ccnc2C)cc1)S(C)(=O)=O Show InChI InChI=1S/C23H30N4O5S/c1-18-25-12-14-27(18)20-6-10-22(11-7-20)31-15-13-24-16-21(28)17-32-23-8-4-19(5-9-23)26(2)33(3,29)30/h4-12,14,21,24,28H,13,15-17H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Berlex Laboratories Curated by ChEMBL					Assay Description In vitro Beta-2 adrenergic receptor affinity in partially purified membrane fractions from canine lung tissue using [SH]dihydroalprenolol (4.5 nM)				J Med Chem 33: 1087-90 (1990) BindingDB Entry DOI: 10.7270/Q2DB82FG
					More data for this Ligand-Target Pair