BDBM50214235 CHEMBL398322::N-(2-hydroxy-5-((S)-2-hydroxy-3-((R)-1-(3-methoxyphenyl)-2-phenylethylamino)propyl)phenyl)methanesulfonamide

SMILES: COc1cccc(c1)[C@@H](Cc1ccccc1)NC[C@@H](O)Cc1ccc(O)c(NS(C)(=O)=O)c1

InChI Key: InChIKey=RDRFEDNBEUPJBQ-JTHBVZDNSA-N

Data: 3 KI

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 = 50214235   

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-3 adrenergic receptor (Homo sapiens (Human))	BDBM50214235 (CHEMBL398322 | N-(2-hydroxy-5-((S)-2-hydroxy-3-((R...) Show SMILES COc1cccc(c1)[C@@H](Cc1ccccc1)NC[C@@H](O)Cc1ccc(O)c(NS(C)(=O)=O)c1 Show InChI InChI=1S/C25H30N2O5S/c1-32-22-10-6-9-20(16-22)23(14-18-7-4-3-5-8-18)26-17-21(28)13-19-11-12-25(29)24(15-19)27-33(2,30)31/h3-12,15-16,21,23,26-29H,13-14,17H2,1-2H3/t21-,23+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	110	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Displacement of [125I]iodocyanopindolol from cloned human adrenergic beta-3 receptor expressed in CHO cells				Bioorg Med Chem Lett 17: 4290-6 (2007) Article DOI: 10.1016/j.bmcl.2007.05.030 BindingDB Entry DOI: 10.7270/Q2M61JZT
					More data for this Ligand-Target Pair
Beta-2 adrenergic receptor (Homo sapiens (Human))	BDBM50214235 (CHEMBL398322 | N-(2-hydroxy-5-((S)-2-hydroxy-3-((R...) Show SMILES COc1cccc(c1)[C@@H](Cc1ccccc1)NC[C@@H](O)Cc1ccc(O)c(NS(C)(=O)=O)c1 Show InChI InChI=1S/C25H30N2O5S/c1-32-22-10-6-9-20(16-22)23(14-18-7-4-3-5-8-18)26-17-21(28)13-19-11-12-25(29)24(15-19)27-33(2,30)31/h3-12,15-16,21,23,26-29H,13-14,17H2,1-2H3/t21-,23+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	350	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Displacement of [125I]iodocyanopindolol from human cloned adrenergic beta-2 receptor expressed in CHO cells				Bioorg Med Chem Lett 17: 4290-6 (2007) Article DOI: 10.1016/j.bmcl.2007.05.030 BindingDB Entry DOI: 10.7270/Q2M61JZT
					More data for this Ligand-Target Pair
Beta-1 adrenergic receptor (Homo sapiens (Human))	BDBM50214235 (CHEMBL398322 | N-(2-hydroxy-5-((S)-2-hydroxy-3-((R...) Show SMILES COc1cccc(c1)[C@@H](Cc1ccccc1)NC[C@@H](O)Cc1ccc(O)c(NS(C)(=O)=O)c1 Show InChI InChI=1S/C25H30N2O5S/c1-32-22-10-6-9-20(16-22)23(14-18-7-4-3-5-8-18)26-17-21(28)13-19-11-12-25(29)24(15-19)27-33(2,30)31/h3-12,15-16,21,23,26-29H,13-14,17H2,1-2H3/t21-,23+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	3.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Displacement of [125I]iodocyanopindolol from human cloned adrenergic beta-1 receptor expressed in CHO cells				Bioorg Med Chem Lett 17: 4290-6 (2007) Article DOI: 10.1016/j.bmcl.2007.05.030 BindingDB Entry DOI: 10.7270/Q2M61JZT
					More data for this Ligand-Target Pair