BDBM50405405 CHEMBL11097

SMILES: COc1ccc(CCNCC(O)COc2ccc(cc2)-c2nc(c[nH]2)C(C)(C)C)cc1OC

InChI Key: InChIKey=XOVWJSJPGSUEGT-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 = 50405405   

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)	BDBM50405405 (CHEMBL11097) Show SMILES COc1ccc(CCNCC(O)COc2ccc(cc2)-c2nc(c[nH]2)C(C)(C)C)cc1OC Show InChI InChI=1S/C26H35N3O4/c1-26(2,3)24-16-28-25(29-24)19-7-9-21(10-8-19)33-17-20(30)15-27-13-12-18-6-11-22(31-4)23(14-18)32-5/h6-11,14,16,20,27,30H,12-13,15,17H2,1-5H3,(H,28,29)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	1.07E+4	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro inhibitory activity against beta-2 adrenergic receptor was measured by the inhibition of isoproterenol-induced relaxation of PGF2-alpha cont...				J Med Chem 29: 1065-80 (1986) BindingDB Entry DOI: 10.7270/Q2BP0408
					More data for this Ligand-Target Pair
Beta-1 adrenergic receptor (GUINEA PIG)	BDBM50405405 (CHEMBL11097) Show SMILES COc1ccc(CCNCC(O)COc2ccc(cc2)-c2nc(c[nH]2)C(C)(C)C)cc1OC Show InChI InChI=1S/C26H35N3O4/c1-26(2,3)24-16-28-25(29-24)19-7-9-21(10-8-19)33-17-20(30)15-27-13-12-18-6-11-22(31-4)23(14-18)32-5/h6-11,14,16,20,27,30H,12-13,15,17H2,1-5H3,(H,28,29)	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro inhibitory activity against beta-1 adrenergic receptor measured by inhibition of positive chronotropic effect of isoproterenolin in isolated...				J Med Chem 29: 1065-80 (1986) BindingDB Entry DOI: 10.7270/Q2BP0408
					More data for this Ligand-Target Pair