BDBM50160824 CHEMBL181603::Methanesulfonic acid 3-{(R)-2-[(R)-2-hydroxy-2-(3-pent-2-enylamino-phenyl)-ethylamino]-propyl}-1H-indol-7-yl ester

SMILES: CC\C=C\CNc1cccc(c1)[C@@H](O)CN[C@H](C)Cc1c[nH]c2c(OS(C)(=O)=O)cccc12

InChI Key: InChIKey=JHCKCVANBRYNHF-AVIWDUSBSA-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 = 50160824   

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-3 adrenergic receptor (Homo sapiens (Human))	BDBM50160824 (CHEMBL181603 | Methanesulfonic acid 3-{(R)-2-[(R)-...) Show SMILES CC\C=C\CNc1cccc(c1)[C@@H](O)CN[C@H](C)Cc1c[nH]c2c(OS(C)(=O)=O)cccc12 Show InChI InChI=1S/C25H33N3O4S/c1-4-5-6-13-26-21-10-7-9-19(15-21)23(29)17-27-18(2)14-20-16-28-25-22(20)11-8-12-24(25)32-33(3,30)31/h5-12,15-16,18,23,26-29H,4,13-14,17H2,1-3H3/b6-5+/t18-,23+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	9	n/a	n/a	n/a	n/a
Dainippon Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Agonistic activity was assessed by measuring cAMP accumulation in CHO cells expressing human beta-3 adrenergic receptor				Bioorg Med Chem Lett 15: 1061-4 (2005) Article DOI: 10.1016/j.bmcl.2004.12.033 BindingDB Entry DOI: 10.7270/Q2TD9WVK
					More data for this Ligand-Target Pair
Beta-2 adrenergic receptor (Homo sapiens (Human))	BDBM50160824 (CHEMBL181603 | Methanesulfonic acid 3-{(R)-2-[(R)-...) Show SMILES CC\C=C\CNc1cccc(c1)[C@@H](O)CN[C@H](C)Cc1c[nH]c2c(OS(C)(=O)=O)cccc12 Show InChI InChI=1S/C25H33N3O4S/c1-4-5-6-13-26-21-10-7-9-19(15-21)23(29)17-27-18(2)14-20-16-28-25-22(20)11-8-12-24(25)32-33(3,30)31/h5-12,15-16,18,23,26-29H,4,13-14,17H2,1-3H3/b6-5+/t18-,23+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	11	n/a	n/a	n/a	n/a
Dainippon Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Agonistic activity was assessed by measuring cAMP accumulation in CHO cells expressing human beta-2 adrenergic receptor				Bioorg Med Chem Lett 15: 1061-4 (2005) Article DOI: 10.1016/j.bmcl.2004.12.033 BindingDB Entry DOI: 10.7270/Q2TD9WVK
					More data for this Ligand-Target Pair