BDBM50405617 CHEMBL66702

SMILES: O[C@H](COCc1ccccc1)[C@H]1CCCCN1

InChI Key: InChIKey=DCJOWWMUIMVZHV-ZIAGYGMSSA-N

Data: 2 Kd

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 = 50405617   

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-2 adrenergic receptor (GUINEA PIG)	BDBM50405617 (CHEMBL66702) Show SMILES O[C@H](COCc1ccccc1)[C@H]1CCCCN1 Show InChI InChI=1S/C14H21NO2/c16-14(13-8-4-5-9-15-13)11-17-10-12-6-2-1-3-7-12/h1-3,6-7,13-16H,4-5,8-11H2/t13-,14-/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	33.9	n/a	n/a	n/a	n/a	n/a
Universidad de Barcelona Curated by ChEMBL					Assay Description Antagonism of isoprenaline-induced relaxation of guinea pig tracheal chains, contracted with carbachol				J Med Chem 31: 2122-6 (1988) BindingDB Entry DOI: 10.7270/Q2J67J4Q
					More data for this Ligand-Target Pair
Beta-1 adrenergic receptor (GUINEA PIG)	BDBM50405617 (CHEMBL66702) Show SMILES O[C@H](COCc1ccccc1)[C@H]1CCCCN1 Show InChI InChI=1S/C14H21NO2/c16-14(13-8-4-5-9-15-13)11-17-10-12-6-2-1-3-7-12/h1-3,6-7,13-16H,4-5,8-11H2/t13-,14-/m1/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	81	n/a	n/a	n/a	n/a	n/a
Universidad de Barcelona Curated by ChEMBL					Assay Description Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium				J Med Chem 31: 2122-6 (1988) BindingDB Entry DOI: 10.7270/Q2J67J4Q
					More data for this Ligand-Target Pair