BDBM50013966 (2-Benzo[1,3]dioxol-5-yl-ethyl)-methyl-(2-pyrrolidin-1-yl-cyclohexyl)-amine::(2R)-N-[2-(2H-1,3-benzodioxol-5-yl)ethyl]-N-methyl-2-(pyrrolidin-1-yl)cyclohexan-1-amine

SMILES: CN(CCc1ccc2OCOc2c1)C1CCCC[C@H]1N1CCCC1

InChI Key: InChIKey=IEXALIKWYRGVDA-QRWMCTBCSA-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 = 50013966   

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))	BDBM50013966 ((2-Benzo[1,3]dioxol-5-yl-ethyl)-methyl-(2-pyrrolid...) Show SMILES CN(CCc1ccc2OCOc2c1)C1CCCC[C@H]1N1CCCC1 Show InChI InChI=1S/C20H30N2O2/c1-21(13-10-16-8-9-19-20(14-16)24-15-23-19)17-6-2-3-7-18(17)22-11-4-5-12-22/h8-9,14,17-18H,2-7,10-13,15H2,1H3/t17?,18-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	31	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Affinity of compound to Sigma opioid receptor labelled with [3H](+)-3-PPP				J Med Chem 33: 3100-10 (1990) BindingDB Entry DOI: 10.7270/Q2348KZJ
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Homo sapiens (Human))	BDBM50013966 ((2-Benzo[1,3]dioxol-5-yl-ethyl)-methyl-(2-pyrrolid...) Show SMILES CN(CCc1ccc2OCOc2c1)C1CCCC[C@H]1N1CCCC1 Show InChI InChI=1S/C20H30N2O2/c1-21(13-10-16-8-9-19-20(14-16)24-15-23-19)17-6-2-3-7-18(17)22-11-4-5-12-22/h8-9,14,17-18H,2-7,10-13,15H2,1H3/t17?,18-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Affinity of compound towards Opioid receptor kappa 1 was determined in presence of [3H]U-69593. radioligand				J Med Chem 33: 3100-10 (1990) BindingDB Entry DOI: 10.7270/Q2348KZJ
					More data for this Ligand-Target Pair