BDBM50086677 6-{2-Hydroxy-3-[4-(2-methoxy-phenyl)-piperazin-1-yl]-propoxy}-4H-benzo[1,4]thiazin-3-one::CHEMBL142474

SMILES: COc1ccccc1N1CCN(CC(O)COc2ccc3SCC(=O)Nc3c2)CC1

InChI Key: InChIKey=QXTUOYRGOXEKPL-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50086677   

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
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor (Rattus norvegicus (rat)-Rattus norvegicus (Rat))	BDBM50086677 (6-{2-Hydroxy-3-[4-(2-methoxy-phenyl)-piperazin-1-y...) Show SMILES COc1ccccc1N1CCN(CC(O)COc2ccc3SCC(=O)Nc3c2)CC1 Show InChI InChI=1S/C22H27N3O4S/c1-28-20-5-3-2-4-19(20)25-10-8-24(9-11-25)13-16(26)14-29-17-6-7-21-18(12-17)23-22(27)15-30-21/h2-7,12,16,26H,8-11,13-15H2,1H3,(H,23,27)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Perugia Curated by ChEMBL					Assay Description Alpha-1 adrenergic receptor binding affinity by measuring the displacement of [3H]prazosin binding in rat brain				Bioorg Med Chem Lett 10: 465-8 (2000) BindingDB Entry DOI: 10.7270/Q2SJ1JVG
					More data for this Ligand-Target Pair
Beta-1 adrenergic receptor (Rattus norvegicus (Rat))	BDBM50086677 (6-{2-Hydroxy-3-[4-(2-methoxy-phenyl)-piperazin-1-y...) Show SMILES COc1ccccc1N1CCN(CC(O)COc2ccc3SCC(=O)Nc3c2)CC1 Show InChI InChI=1S/C22H27N3O4S/c1-28-20-5-3-2-4-19(20)25-10-8-24(9-11-25)13-16(26)14-29-17-6-7-21-18(12-17)23-22(27)15-30-21/h2-7,12,16,26H,8-11,13-15H2,1H3,(H,23,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Perugia Curated by ChEMBL					Assay Description Compound was evaluated for its Beta-1 adrenergic receptor binding affinity by measuring the displacement of [3H]-dihydroalprenolol binding in rat hea...				Bioorg Med Chem Lett 10: 465-8 (2000) BindingDB Entry DOI: 10.7270/Q2SJ1JVG
					More data for this Ligand-Target Pair
Adrenergic receptor alpha-2 (RAT-NEONATAL RAT-Rattus norvegicus (rat))	BDBM50086677 (6-{2-Hydroxy-3-[4-(2-methoxy-phenyl)-piperazin-1-y...) Show SMILES COc1ccccc1N1CCN(CC(O)COc2ccc3SCC(=O)Nc3c2)CC1 Show InChI InChI=1S/C22H27N3O4S/c1-28-20-5-3-2-4-19(20)25-10-8-24(9-11-25)13-16(26)14-29-17-6-7-21-18(12-17)23-22(27)15-30-21/h2-7,12,16,26H,8-11,13-15H2,1H3,(H,23,27)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Perugia Curated by ChEMBL					Assay Description Alpha-2 adrenergic receptor binding affinity by measuring the displacement of [3H]clonidine binding in rat cerebral cortex				Bioorg Med Chem Lett 10: 465-8 (2000) BindingDB Entry DOI: 10.7270/Q2SJ1JVG
					More data for this Ligand-Target Pair
Beta-2 adrenergic receptor (Canis familiaris)	BDBM50086677 (6-{2-Hydroxy-3-[4-(2-methoxy-phenyl)-piperazin-1-y...) Show SMILES COc1ccccc1N1CCN(CC(O)COc2ccc3SCC(=O)Nc3c2)CC1 Show InChI InChI=1S/C22H27N3O4S/c1-28-20-5-3-2-4-19(20)25-10-8-24(9-11-25)13-16(26)14-29-17-6-7-21-18(12-17)23-22(27)15-30-21/h2-7,12,16,26H,8-11,13-15H2,1H3,(H,23,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Perugia Curated by ChEMBL					Assay Description Beta-2 adrenergic receptor binding affinity by measuring the displacement of [3H]-DHA binding in rat lung				Bioorg Med Chem Lett 10: 465-8 (2000) BindingDB Entry DOI: 10.7270/Q2SJ1JVG
					More data for this Ligand-Target Pair