BDBM50061248 (1R)-1-(3-bromophenyl)-2-(2,3-dihydro-1'H-spiro[indene-1,4'-piperidin]-1'-yl)ethanol::CHEMBL126019

SMILES: O[C@@H](CN1CCC2(CCc3ccccc23)CC1)c1cccc(Br)c1

InChI Key: InChIKey=DXHPZDGAIGSHFQ-FQEVSTJZSA-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 = 50061248   

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))	BDBM50061248 ((1R)-1-(3-bromophenyl)-2-(2,3-dihydro-1'H-spiro[in...) Show SMILES O[C@@H](CN1CCC2(CCc3ccccc23)CC1)c1cccc(Br)c1 Show InChI InChI=1S/C21H24BrNO/c22-18-6-3-5-17(14-18)20(24)15-23-12-10-21(11-13-23)9-8-16-4-1-2-7-19(16)21/h1-7,14,20,24H,8-13,15H2/t20-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	107	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Sigma-1 binding assay was done in guinea pig membranes by labelling the binding site with [3H]-(+)-pentazocine				J Med Chem 40: 3905-14 (1998) Article DOI: 10.1021/jm970326r BindingDB Entry DOI: 10.7270/Q2KK99WJ
					More data for this Ligand-Target Pair
Vesicular acetylcholine transporter (Homo sapiens (Human))	BDBM50061248 ((1R)-1-(3-bromophenyl)-2-(2,3-dihydro-1'H-spiro[in...) Show SMILES O[C@@H](CN1CCC2(CCc3ccccc23)CC1)c1cccc(Br)c1 Show InChI InChI=1S/C21H24BrNO/c22-18-6-3-5-17(14-18)20(24)15-23-12-10-21(11-13-23)9-8-16-4-1-2-7-19(16)21/h1-7,14,20,24H,8-13,15H2/t20-/m0/s1	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	600	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Binding to vesicular acetylcholine transporter of torpedo synaptic vesicles				J Med Chem 40: 3905-14 (1998) Article DOI: 10.1021/jm970326r BindingDB Entry DOI: 10.7270/Q2KK99WJ
					More data for this Ligand-Target Pair