BDBM50404802 CHEMBL31542

SMILES: CCOC(=O)C(NCC(O)COc1ccc(CCC(=O)OC)cc1)C(=O)OCC

InChI Key: InChIKey=QRAIKLUFCJMUNA-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50404802   

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 (GUINEA PIG)	BDBM50404802 (CHEMBL31542) Show SMILES CCOC(=O)C(NCC(O)COc1ccc(CCC(=O)OC)cc1)C(=O)OCC Show InChI InChI=1S/C20H29NO8/c1-4-27-19(24)18(20(25)28-5-2)21-12-15(22)13-29-16-9-6-14(7-10-16)8-11-17(23)26-3/h6-7,9-10,15,18,21-22H,4-5,8,11-13H2,1-3H3	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Ability to block Beta-1 adrenergic receptor in guinea pig right atria preparation				J Med Chem 25: 1408-12 (1983) BindingDB Entry DOI: 10.7270/Q2S183PB
					More data for this Ligand-Target Pair