BDBM50089482 4-[5-(3-Fluoro-benzyl)-[1,2,4]oxadiazol-3-yl]-N-{4-[2-((R)-2-hydroxy-2-pyridin-3-yl-ethylamino)-ethyl]-phenyl}-benzenesulfonamide::CHEMBL287561

SMILES: O[C@@H](CNCCc1ccc(NS(=O)(=O)c2ccc(cc2)-c2noc(Cc3cccc(F)c3)n2)cc1)c1cccnc1

InChI Key: InChIKey=SBACQNMIKWVEKA-NDEPHWFRSA-N

Data: 2 IC50  1 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 = 50089482   

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))	BDBM50089482 (4-[5-(3-Fluoro-benzyl)-[1,2,4]oxadiazol-3-yl]-N-{4...) Show SMILES O[C@@H](CNCCc1ccc(NS(=O)(=O)c2ccc(cc2)-c2noc(Cc3cccc(F)c3)n2)cc1)c1cccnc1 Show InChI InChI=1S/C30H28FN5O4S/c31-25-5-1-3-22(17-25)18-29-34-30(35-40-29)23-8-12-27(13-9-23)41(38,39)36-26-10-6-21(7-11-26)14-16-33-20-28(37)24-4-2-15-32-19-24/h1-13,15,17,19,28,33,36-37H,14,16,18,20H2/t28-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	695	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to recombinant human beta-2 adrenergic receptor prepared from CHO cells in the presence of [125I]-iodocyanopindolol				Bioorg Med Chem Lett 10: 1431-4 (2000) BindingDB Entry DOI: 10.7270/Q24B30JM
					More data for this Ligand-Target Pair
Beta-1 adrenergic receptor (Homo sapiens (Human))	BDBM50089482 (4-[5-(3-Fluoro-benzyl)-[1,2,4]oxadiazol-3-yl]-N-{4...) Show SMILES O[C@@H](CNCCc1ccc(NS(=O)(=O)c2ccc(cc2)-c2noc(Cc3cccc(F)c3)n2)cc1)c1cccnc1 Show InChI InChI=1S/C30H28FN5O4S/c31-25-5-1-3-22(17-25)18-29-34-30(35-40-29)23-8-12-27(13-9-23)41(38,39)36-26-10-6-21(7-11-26)14-16-33-20-28(37)24-4-2-15-32-19-24/h1-13,15,17,19,28,33,36-37H,14,16,18,20H2/t28-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to recombinant human beta-1 adrenergic receptor expressed in CHO cells in the presence of [125I]-iodocyanopindolol				Bioorg Med Chem Lett 10: 1431-4 (2000) BindingDB Entry DOI: 10.7270/Q24B30JM
					More data for this Ligand-Target Pair
Beta-3 adrenergic receptor (Homo sapiens (Human))	BDBM50089482 (4-[5-(3-Fluoro-benzyl)-[1,2,4]oxadiazol-3-yl]-N-{4...) Show SMILES O[C@@H](CNCCc1ccc(NS(=O)(=O)c2ccc(cc2)-c2noc(Cc3cccc(F)c3)n2)cc1)c1cccnc1 Show InChI InChI=1S/C30H28FN5O4S/c31-25-5-1-3-22(17-25)18-29-34-30(35-40-29)23-8-12-27(13-9-23)41(38,39)36-26-10-6-21(7-11-26)14-16-33-20-28(37)24-4-2-15-32-19-24/h1-13,15,17,19,28,33,36-37H,14,16,18,20H2/t28-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	12	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Stimulation of cAMP levels in CHO cells expressing the recombinant human beta-3 adrenergic receptor				Bioorg Med Chem Lett 10: 1431-4 (2000) BindingDB Entry DOI: 10.7270/Q24B30JM
					More data for this Ligand-Target Pair