BDBM50040069 2-Chloro-5-{2-[2-hydroxy-3-(3-oxo-3,4-dihydro-2H-benzo[1,4]thiazin-8-yloxy)-propylamino]-ethylamino}-benzenesulfonamide::CHEMBL43968

SMILES: NS(=O)(=O)c1cc(NCCNCC(O)COc2cccc3NC(=O)CSc23)ccc1Cl

InChI Key: InChIKey=KKQBSEGENLKPKF-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50040069   

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))	BDBM50040069 (2-Chloro-5-{2-[2-hydroxy-3-(3-oxo-3,4-dihydro-2H-b...) Show SMILES NS(=O)(=O)c1cc(NCCNCC(O)COc2cccc3NC(=O)CSc23)ccc1Cl Show InChI InChI=1S/C19H23ClN4O5S2/c20-14-5-4-12(8-17(14)31(21,27)28)23-7-6-22-9-13(25)10-29-16-3-1-2-15-19(16)30-11-18(26)24-15/h1-5,8,13,22-23,25H,6-7,9-11H2,(H,24,26)(H2,21,27,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	7.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Perugia Curated by ChEMBL					Assay Description Inhibition of [3H]-Dihydroalprenolol binding to beta 1 adrenoceptor from turkey erythrocyte membranes.				J Med Chem 36: 157-61 (1993) BindingDB Entry DOI: 10.7270/Q2ZK5FQV
					More data for this Ligand-Target Pair