BDBM50538796 CHEMBL4636255

SMILES: Cl.CC(C)(CCc1cccc(O)c1)NCC(O)c1cc(O)cc2NC(=O)COc12

InChI Key: InChIKey=QZZQNYSUVCVWOK-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50538796   

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 (Homo sapiens (Human))	BDBM50538796 (CHEMBL4636255) Show SMILES Cl.CC(C)(CCc1cccc(O)c1)NCC(O)c1cc(O)cc2NC(=O)COc12 Show InChI InChI=1S/C21H26N2O5.ClH/c1-21(2,7-6-13-4-3-5-14(24)8-13)22-11-18(26)16-9-15(25)10-17-20(16)28-12-19(27)23-17;/h3-5,8-10,18,22,24-26H,6-7,11-12H2,1-2H3,(H,23,27);1H	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	n/a	4.20	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Agonist activity at human beta1 adrenoreceptor overexpressed in human HEK293 cells assessed as cAMP accumulation incubated for 60 mins by HTRF assay				Bioorg Med Chem 28: (2020)
					More data for this Ligand-Target Pair
Beta-2 adrenergic receptor (Homo sapiens (Human))	BDBM50538796 (CHEMBL4636255) Show SMILES Cl.CC(C)(CCc1cccc(O)c1)NCC(O)c1cc(O)cc2NC(=O)COc12 Show InChI InChI=1S/C21H26N2O5.ClH/c1-21(2,7-6-13-4-3-5-14(24)8-13)22-11-18(26)16-9-15(25)10-17-20(16)28-12-19(27)23-17;/h3-5,8-10,18,22,24-26H,6-7,11-12H2,1-2H3,(H,23,27);1H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	n/a	0.0309	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Agonist activity at human beta2 adrenoreceptor overexpressed in human HEK293 cells assessed as cAMP accumulation incubated for 60 mins by HTRF assay				Bioorg Med Chem 28: (2020)
					More data for this Ligand-Target Pair