BDBM50106822 CHEMBL103219::N-{5-[2-(1-Benzyl-6-hydroxy-hexylamino)-1-hydroxy-ethyl]-2-hydroxy-phenyl}-methanesulfonamide

SMILES: CS(=O)(=O)Nc1cc(ccc1O)C(O)CNC(CCCCCO)Cc1ccccc1

InChI Key: InChIKey=JUHZUCWXDYDXTC-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50106822   

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))	BDBM50106822 (CHEMBL103219 | N-{5-[2-(1-Benzyl-6-hydroxy-hexylam...) Show SMILES CS(=O)(=O)Nc1cc(ccc1O)C(O)CNC(CCCCCO)Cc1ccccc1 Show InChI InChI=1S/C22H32N2O5S/c1-30(28,29)24-20-15-18(11-12-21(20)26)22(27)16-23-19(10-6-3-7-13-25)14-17-8-4-2-5-9-17/h2,4-5,8-9,11-12,15,19,22-27H,3,6-7,10,13-14,16H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	480	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 Binding affinity against CHO cells transfected with human beta-3 adrenergic receptor in the presence of [125I]iodocyanopindolol				Bioorg Med Chem Lett 11: 3035-9 (2001) BindingDB Entry DOI: 10.7270/Q2MS3T97
					More data for this Ligand-Target Pair