BDBM50404791 CHEMBL31025

SMILES: COC(=O)CCc1ccc(OCC(O)CNC(C)(C)C)cc1

InChI Key: InChIKey=ZSVATMHGHAZWON-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50404791   

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)	BDBM50404791 (CHEMBL31025) Show SMILES COC(=O)CCc1ccc(OCC(O)CNC(C)(C)C)cc1 Show InChI InChI=1S/C17H27NO4/c1-17(2,3)18-11-14(19)12-22-15-8-5-13(6-9-15)7-10-16(20)21-4/h5-6,8-9,14,18-19H,7,10-12H2,1-4H3	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	316	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
Beta-2 adrenergic receptor (GUINEA PIG)	BDBM50404791 (CHEMBL31025) Show SMILES COC(=O)CCc1ccc(OCC(O)CNC(C)(C)C)cc1 Show InChI InChI=1S/C17H27NO4/c1-17(2,3)18-11-14(19)12-22-15-8-5-13(6-9-15)7-10-16(20)21-4/h5-6,8-9,14,18-19H,7,10-12H2,1-4H3	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	1.26E+3	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Ability to block Beta-2 adrenergic receptor in guinea pig trachea preparation				J Med Chem 25: 1408-12 (1983) BindingDB Entry DOI: 10.7270/Q2S183PB
					More data for this Ligand-Target Pair
Beta-1 adrenergic receptor (GUINEA PIG)	BDBM50404791 (CHEMBL31025) Show SMILES COC(=O)CCc1ccc(OCC(O)CNC(C)(C)C)cc1 Show InChI InChI=1S/C17H27NO4/c1-17(2,3)18-11-14(19)12-22-15-8-5-13(6-9-15)7-10-16(20)21-4/h5-6,8-9,14,18-19H,7,10-12H2,1-4H3	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	0.00000100	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 at a duration of 3h				J Med Chem 25: 1408-12 (1983) BindingDB Entry DOI: 10.7270/Q2S183PB
					More data for this Ligand-Target Pair
Beta-1 adrenergic receptor (GUINEA PIG)	BDBM50404791 (CHEMBL31025) Show SMILES COC(=O)CCc1ccc(OCC(O)CNC(C)(C)C)cc1 Show InChI InChI=1S/C17H27NO4/c1-17(2,3)18-11-14(19)12-22-15-8-5-13(6-9-15)7-10-16(20)21-4/h5-6,8-9,14,18-19H,7,10-12H2,1-4H3	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	100	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 at a duration of 40 min				J Med Chem 25: 1408-12 (1983) BindingDB Entry DOI: 10.7270/Q2S183PB
					More data for this Ligand-Target Pair