BDBM50272840 5-[((7S)-7-{[(2R)-2-(3-Chlorophenyl)-2-hydroxyethyl]amino}-5,6,7,8-tetrahydro-2-naphthalenyl)oxy]-2-thiophenecarboxylic Acid::CHEMBL497280

SMILES: O[C@@H](CN[C@H]1CCc2ccc(Oc3ccc(s3)C(O)=O)cc2C1)c1cccc(Cl)c1

InChI Key: InChIKey=ICMKXYZWRPPWMR-ICSRJNTNSA-N

Data: 3 EC50

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 3 hits for monomerid = 50272840   

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 (Homo sapiens (Human))	BDBM50272840 (5-[((7S)-7-{[(2R)-2-(3-Chlorophenyl)-2-hydroxyethy...) Show SMILES O[C@@H](CN[C@H]1CCc2ccc(Oc3ccc(s3)C(O)=O)cc2C1)c1cccc(Cl)c1 |r| Show InChI InChI=1S/C23H22ClNO4S/c24-17-3-1-2-15(10-17)20(26)13-25-18-6-4-14-5-7-19(12-16(14)11-18)29-22-9-8-21(30-22)23(27)28/h1-3,5,7-10,12,18,20,25-26H,4,6,11,13H2,(H,27,28)/t18-,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a
Astellas Pharma Inc Curated by ChEMBL					Assay Description Agonist activity at human beta2 adrenergic receptor expressed in CHO cells assessed as cAMP accumulation				J Med Chem 51: 4804-22 (2008) Article DOI: 10.1021/jm800222k BindingDB Entry DOI: 10.7270/Q25D8SQ8
					More data for this Ligand-Target Pair
Beta-3 adrenergic receptor (Homo sapiens (Human))	BDBM50272840 (5-[((7S)-7-{[(2R)-2-(3-Chlorophenyl)-2-hydroxyethy...) Show SMILES O[C@@H](CN[C@H]1CCc2ccc(Oc3ccc(s3)C(O)=O)cc2C1)c1cccc(Cl)c1 |r| Show InChI InChI=1S/C23H22ClNO4S/c24-17-3-1-2-15(10-17)20(26)13-25-18-6-4-14-5-7-19(12-16(14)11-18)29-22-9-8-21(30-22)23(27)28/h1-3,5,7-10,12,18,20,25-26H,4,6,11,13H2,(H,27,28)/t18-,20-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	5.70	n/a	n/a	n/a	n/a
Astellas Pharma Inc Curated by ChEMBL					Assay Description Agonist activity at human cloned beta3 adrenergic receptor expressed in CHO cells assessed as cAMP accumulation				J Med Chem 51: 4804-22 (2008) Article DOI: 10.1021/jm800222k BindingDB Entry DOI: 10.7270/Q25D8SQ8
					More data for this Ligand-Target Pair
Beta-1 adrenergic receptor (Homo sapiens (Human))	BDBM50272840 (5-[((7S)-7-{[(2R)-2-(3-Chlorophenyl)-2-hydroxyethy...) Show SMILES O[C@@H](CN[C@H]1CCc2ccc(Oc3ccc(s3)C(O)=O)cc2C1)c1cccc(Cl)c1 |r| Show InChI InChI=1S/C23H22ClNO4S/c24-17-3-1-2-15(10-17)20(26)13-25-18-6-4-14-5-7-19(12-16(14)11-18)29-22-9-8-21(30-22)23(27)28/h1-3,5,7-10,12,18,20,25-26H,4,6,11,13H2,(H,27,28)/t18-,20-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	670	n/a	n/a	n/a	n/a
Astellas Pharma Inc Curated by ChEMBL					Assay Description Agonist activity at human cloned beta-1 adrenergic receptor expressed in CHO cells assessed as cAMP accumulation				J Med Chem 51: 4804-22 (2008) Article DOI: 10.1021/jm800222k BindingDB Entry DOI: 10.7270/Q25D8SQ8
					More data for this Ligand-Target Pair