BDBM50081380 CHEMBL553962::[1-(4-Methoxy-3-phenethyloxy-benzyl)-hexyl]-propyl-amine; hydrochloride

SMILES: CCCCCC(Cc1ccc(OC)c(OCCc2ccccc2)c1)NCCC

InChI Key: InChIKey=MJBHVLQRUJWZQC-UHFFFAOYSA-N

Data: 3 IC50

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 = 50081380   

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
Sigma non-opioid intracellular receptor 1 (Homo sapiens (Human))	BDBM50081380 (CHEMBL553962 | [1-(4-Methoxy-3-phenethyloxy-benzyl...) Show SMILES CCCCCC(Cc1ccc(OC)c(OCCc2ccccc2)c1)NCCC Show InChI InChI=1S/C25H37NO2/c1-4-6-8-13-23(26-17-5-2)19-22-14-15-24(27-3)25(20-22)28-18-16-21-11-9-7-10-12-21/h7,9-12,14-15,20,23,26H,4-6,8,13,16-19H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.5	n/a	n/a	n/a	n/a	n/a	n/a
Taisho Pharmaceutical Company Ltd. Curated by ChEMBL					Assay Description In vitro binding affinity at Sigma opioid receptors on guinea pig brain membranes by [3H]3-PPP displacement.				J Med Chem 42: 3965-70 (1999) BindingDB Entry DOI: 10.7270/Q2PR7WQ7
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50081380 (CHEMBL553962 | [1-(4-Methoxy-3-phenethyloxy-benzyl...) Show SMILES CCCCCC(Cc1ccc(OC)c(OCCc2ccccc2)c1)NCCC Show InChI InChI=1S/C25H37NO2/c1-4-6-8-13-23(26-17-5-2)19-22-14-15-24(27-3)25(20-22)28-18-16-21-11-9-7-10-12-21/h7,9-12,14-15,20,23,26H,4-6,8,13,16-19H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Taisho Pharmaceutical Company Ltd. Curated by ChEMBL					Assay Description In vitro binding affinity at Dopamine receptor D2 of rat striatal membranes by [3H]-raclopride displacement.				J Med Chem 42: 3965-70 (1999) BindingDB Entry DOI: 10.7270/Q2PR7WQ7
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Homo sapiens (Human))	BDBM50081380 (CHEMBL553962 | [1-(4-Methoxy-3-phenethyloxy-benzyl...) Show SMILES CCCCCC(Cc1ccc(OC)c(OCCc2ccccc2)c1)NCCC Show InChI InChI=1S/C25H37NO2/c1-4-6-8-13-23(26-17-5-2)19-22-14-15-24(27-3)25(20-22)28-18-16-21-11-9-7-10-12-21/h7,9-12,14-15,20,23,26H,4-6,8,13,16-19H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
Taisho Pharmaceutical Company Ltd. Curated by ChEMBL					Assay Description TIn vitro binding affinity at Sigma opioid receptor type 2 on guinea pig brain membranes by [3H]DTG displacement in the presence of [3H]pentazocine.				J Med Chem 42: 3965-70 (1999) BindingDB Entry DOI: 10.7270/Q2PR7WQ7
					More data for this Ligand-Target Pair