BDBM50017489 2-Benzo[b]thiophen-5-yl-N-methyl-N-(2-pyrrolidin-1-yl-cyclohexyl)-acetamide; hydrochloride::CHEMBL536550

SMILES: CN([C@@H]1CCCC[C@H]1N1CCCC1)C(=O)Cc1ccc2sccc2c1

InChI Key: InChIKey=ICNOWNMNRPXVFW-RTBURBONSA-N

Data: 2 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 2 hits for monomerid = 50017489   

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
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50017489 (2-Benzo[b]thiophen-5-yl-N-methyl-N-(2-pyrrolidin-1...) Show SMILES CN([C@@H]1CCCC[C@H]1N1CCCC1)C(=O)Cc1ccc2sccc2c1 Show InChI InChI=1S/C21H28N2OS/c1-22(18-6-2-3-7-19(18)23-11-4-5-12-23)21(24)15-16-8-9-20-17(14-16)10-13-25-20/h8-10,13-14,18-19H,2-7,11-12,15H2,1H3/t18-,19-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	94	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Parke-Davis Research Unit Curated by ChEMBL					Assay Description Binding affinity towards opioid receptor kappa was determined				J Med Chem 32: 1620-6 (1989) BindingDB Entry DOI: 10.7270/Q2GH9JJB
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50017489 (2-Benzo[b]thiophen-5-yl-N-methyl-N-(2-pyrrolidin-1...) Show SMILES CN([C@@H]1CCCC[C@H]1N1CCCC1)C(=O)Cc1ccc2sccc2c1 Show InChI InChI=1S/C21H28N2OS/c1-22(18-6-2-3-7-19(18)23-11-4-5-12-23)21(24)15-16-8-9-20-17(14-16)10-13-25-20/h8-10,13-14,18-19H,2-7,11-12,15H2,1H3/t18-,19-/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	475	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Parke-Davis Research Unit Curated by ChEMBL					Assay Description Binding affinity towards opioid receptor mu was determined				J Med Chem 32: 1620-6 (1989) BindingDB Entry DOI: 10.7270/Q2GH9JJB
					More data for this Ligand-Target Pair