BDBM50119796 1,1'-(hexane-1,6-diyl)diquinolinium iodide::1,6-di(1-quinoliniumyl)hexane; with diiodide ions::CHEMBL430870::CHEMBL601410

SMILES: C(CCC[n+]1cccc2ccccc12)CC[n+]1cccc2ccccc12

InChI Key: InChIKey=CHWJVANCPFQFAA-UHFFFAOYSA-N

Data: 2 KI  2 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 4 hits for monomerid = 50119796   

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
Acetylcholinesterase (Homo sapiens (human))	BDBM50119796 (1,1'-(hexane-1,6-diyl)diquinolinium iodide | 1,6-d...) Show SMILES C(CCC[n+]1cccc2ccccc12)CC[n+]1cccc2ccccc12 Show InChI InChI=1S/C24H26N2/c1(7-17-25-19-9-13-21-11-3-5-15-23(21)25)2-8-18-26-20-10-14-22-12-4-6-16-24(22)26/h3-6,9-16,19-20H,1-2,7-8,17-18H2/q+2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Charles University Curated by ChEMBL					Assay Description Inhibition of human erythrocyte recombinant AChE by modified Ellman's method				Bioorg Med Chem Lett 21: 2505-9 (2011) Article DOI: 10.1016/j.bmcl.2011.02.047 BindingDB Entry DOI: 10.7270/Q2JW8F6N
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor (Rattus norvegicus (Rat))	BDBM50119796 (1,1'-(hexane-1,6-diyl)diquinolinium iodide | 1,6-d...) Show SMILES C(CCC[n+]1cccc2ccccc12)CC[n+]1cccc2ccccc12 Show InChI InChI=1S/C24H26N2/c1(7-17-25-19-9-13-21-11-3-5-15-23(21)25)2-8-18-26-20-10-14-22-12-4-6-16-24(22)26/h3-6,9-16,19-20H,1-2,7-8,17-18H2/q+2	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.33E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Kentucky Curated by ChEMBL					Assay Description Binding affinity nicotinic acetylcholine receptor alpha-7 was evaluated by its ability to inhibit [3H]methyllycaconitine ([3H]-MLA) binding to rat br...				Bioorg Med Chem Lett 12: 3067-71 (2002) Article DOI: 10.1016/s0960-894x(02)00687-x BindingDB Entry DOI: 10.7270/Q2Q81DNR
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit (Rattus norvegicus (Rat))	BDBM50119796 (1,1'-(hexane-1,6-diyl)diquinolinium iodide | 1,6-d...) Show SMILES C(CCC[n+]1cccc2ccccc12)CC[n+]1cccc2ccccc12 Show InChI InChI=1S/C24H26N2/c1(7-17-25-19-9-13-21-11-3-5-15-23(21)25)2-8-18-26-20-10-14-22-12-4-6-16-24(22)26/h3-6,9-16,19-20H,1-2,7-8,17-18H2/q+2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.93E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Kentucky Curated by ChEMBL					Assay Description Binding affinity for nicotinic acetylcholine receptor alpha4-beta2 was evaluated by its ability to inhibit [3H]NIC binding to rat brain membranes				Bioorg Med Chem Lett 12: 3067-71 (2002) Article DOI: 10.1016/s0960-894x(02)00687-x BindingDB Entry DOI: 10.7270/Q2Q81DNR
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (human))	BDBM50119796 (1,1'-(hexane-1,6-diyl)diquinolinium iodide | 1,6-d...) Show SMILES C(CCC[n+]1cccc2ccccc12)CC[n+]1cccc2ccccc12 Show InChI InChI=1S/C24H26N2/c1(7-17-25-19-9-13-21-11-3-5-15-23(21)25)2-8-18-26-20-10-14-22-12-4-6-16-24(22)26/h3-6,9-16,19-20H,1-2,7-8,17-18H2/q+2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Charles University Curated by ChEMBL					Assay Description Inhibition of human plasmatic BChE by modified Ellman's method				Bioorg Med Chem Lett 21: 2505-9 (2011) Article DOI: 10.1016/j.bmcl.2011.02.047 BindingDB Entry DOI: 10.7270/Q2JW8F6N
					More data for this Ligand-Target Pair