BDBM50421323 CHEMBL2088195

SMILES: CCc1cc2CC(Cc2cc1CC)NCC(O)c1c(C)cc(O)c2[nH]c(=O)ccc12

InChI Key: InChIKey=IAYCRMOPCKGMOQ-UHFFFAOYSA-N

Data: 2 KI

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 = 50421323   

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))	BDBM50421323 (CHEMBL2088195) Show SMILES CCc1cc2CC(Cc2cc1CC)NCC(O)c1c(C)cc(O)c2[nH]c(=O)ccc12 Show InChI InChI=1S/C25H30N2O3/c1-4-15-9-17-11-19(12-18(17)10-16(15)5-2)26-13-22(29)24-14(3)8-21(28)25-20(24)6-7-23(30)27-25/h6-10,19,22,26,28-29H,4-5,11-13H2,1-3H3,(H,27,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	515	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Binding affinity to human beta2-adrenoceptor by radioligand binding assay				Bioorg Med Chem Lett 22: 6280-5 (2012) Article DOI: 10.1016/j.bmcl.2012.07.096 BindingDB Entry DOI: 10.7270/Q2G73G09
					More data for this Ligand-Target Pair
Beta-1 adrenergic receptor (Homo sapiens (Human))	BDBM50421323 (CHEMBL2088195) Show SMILES CCc1cc2CC(Cc2cc1CC)NCC(O)c1c(C)cc(O)c2[nH]c(=O)ccc12 Show InChI InChI=1S/C25H30N2O3/c1-4-15-9-17-11-19(12-18(17)10-16(15)5-2)26-13-22(29)24-14(3)8-21(28)25-20(24)6-7-23(30)27-25/h6-10,19,22,26,28-29H,4-5,11-13H2,1-3H3,(H,27,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Binding affinity to human beta1-adrenoceptor by radioligand binding assay				Bioorg Med Chem Lett 22: 6280-5 (2012) Article DOI: 10.1016/j.bmcl.2012.07.096 BindingDB Entry DOI: 10.7270/Q2G73G09
					More data for this Ligand-Target Pair