BDBM50039607 1-(2-iodobenzyl)-3-spiro[1H-indene-1,4'-(hexahydropyridine)]-1-yl-(3R,4R)-hexahydro-4-pyridinol::CHEMBL87214

SMILES: O[C@@H]1CCN(Cc2ccccc2I)C[C@H]1N1CCC2(CC1)C=Cc1ccccc21

InChI Key: InChIKey=ABKRNZRWTZVQGQ-DNQXCXABSA-N

Data: 1 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 1 hit for monomerid = 50039607   

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
Vesicular acetylcholine transporter (Torpedo californica)	BDBM50039607 (1-(2-iodobenzyl)-3-spiro[1H-indene-1,4'-(hexahydro...) Show SMILES O[C@@H]1CCN(Cc2ccccc2I)C[C@H]1N1CCC2(CC1)C=Cc1ccccc21 |c:24| Show InChI InChI=1S/C25H29IN2O/c26-22-8-4-2-6-20(22)17-27-14-10-24(29)23(18-27)28-15-12-25(13-16-28)11-9-19-5-1-3-7-21(19)25/h1-9,11,23-24,29H,10,12-18H2/t23-,24-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.798	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description In vitro binding affinity to vesamicol receptor using [3H]-vesamicol.				J Med Chem 37: 2574-82 (1994) BindingDB Entry DOI: 10.7270/Q2HH6J44
					More data for this Ligand-Target Pair