BDBM50404993 CHEMBL174783

SMILES: CC(C)(C)NCC(O)COc1ccc(cc1)-c1ncc[nH]1

InChI Key: InChIKey=HBYIEJQLZYCNSI-UHFFFAOYSA-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 = 50404993   

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)	BDBM50404993 (CHEMBL174783) Show SMILES CC(C)(C)NCC(O)COc1ccc(cc1)-c1ncc[nH]1 Show InChI InChI=1S/C16H23N3O2/c1-16(2,3)19-10-13(20)11-21-14-6-4-12(5-7-14)15-17-8-9-18-15/h4-9,13,19-20H,10-11H2,1-3H3,(H,17,18)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	617	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro beta-2 adrenergic receptor activity was determined by measuring inhibition of the isoproterenol induced relaxation in isolated guinea pig tr...				J Med Chem 26: 950-7 (1983) BindingDB Entry DOI: 10.7270/Q2GH9K4C
					More data for this Ligand-Target Pair
Beta-1 adrenergic receptor (GUINEA PIG)	BDBM50404993 (CHEMBL174783) Show SMILES CC(C)(C)NCC(O)COc1ccc(cc1)-c1ncc[nH]1 Show InChI InChI=1S/C16H23N3O2/c1-16(2,3)19-10-13(20)11-21-14-6-4-12(5-7-14)15-17-8-9-18-15/h4-9,13,19-20H,10-11H2,1-3H3,(H,17,18)	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro beta-1 adrenergic receptor activity was determined via inhibition of the positive chronotropic actions of isoproterenol in isolated guinea p...				J Med Chem 26: 950-7 (1983) BindingDB Entry DOI: 10.7270/Q2GH9K4C
					More data for this Ligand-Target Pair