BindingDB PrimarySearch

BDBM50038416 (1,6-trimethyl ammonium)hexane; dibromide::CHEMBL100622::CHEMBL332524::HEXAMETHONIUM::HEXAMETHONIUM BROMIDE::HEXAMETHONIUM CHLORIDE::Hexamethoniumdibromide::N,N,N,N'',N'',N''-Hexamethyl-1,6-hexanediaminium dibromide::N,N,N,N'',N'',N''-Hexamethylhexane-1,6-diammoniumdibromide

SMILES: C[N+](C)(C)CCCCCC[N+](C)(C)C

InChI Key: InChIKey=VZJFGSRCJCXDSG-UHFFFAOYSA-N

Data: 14 KI 1 Kd

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 15 hits for monomerid = 50038416
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
n-AChR (RAT)	BDBM50038416 ((1,6-trimethyl ammonium)hexane; dibromide \| CHEMBL...) Show SMILES C[N+](C)(C)CCCCCC[N+](C)(C)C Show InChI	GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Similars	PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
R. J. Reynolds Tobacco Company Curated by PDSP K_i Database									Mol Pharmacol 29: 448-54 (1986) BindingDB Entry DOI: 10.7270/Q269722Z
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50038416 ((1,6-trimethyl ammonium)hexane; dibromide \| CHEMBL...) Show SMILES C[N+](C)(C)CCCCCC[N+](C)(C)C Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by PDSP K_i Database									Proc Natl Acad Sci U S A 81: 4983-7 (1984) Article DOI: 10.1073/pnas.81.15.4983 BindingDB Entry DOI: 10.7270/Q2JM284N
TBA Curated by PDSP K_i Database					More data for this Ligand-Target Pair
Cholinergic, Nicotinic Alpha6Beta4 (Chick)	BDBM50038416 ((1,6-trimethyl ammonium)hexane; dibromide \| CHEMBL...) Show SMILES C[N+](C)(C)CCCCCC[N+](C)(C)C Show InChI	PDB GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Milan Curated by PDSP K_i Database									Mol Pharmacol 63: 1329-37 (2003) Article DOI: 10.1124/mol.63.6.1329 BindingDB Entry DOI: 10.7270/Q29W0D27
University of Milan Curated by PDSP K_i Database					More data for this Ligand-Target Pair
Cholinergic, Nicotinic Alpha6Beta2 (Chick)	BDBM50038416 ((1,6-trimethyl ammonium)hexane; dibromide \| CHEMBL...) Show SMILES C[N+](C)(C)CCCCCC[N+](C)(C)C Show InChI	GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Milan Curated by PDSP K_i Database									Mol Pharmacol 63: 1329-37 (2003) Article DOI: 10.1124/mol.63.6.1329 BindingDB Entry DOI: 10.7270/Q29W0D27
University of Milan Curated by PDSP K_i Database					More data for this Ligand-Target Pair
n-AChR (RAT)	BDBM50038416 ((1,6-trimethyl ammonium)hexane; dibromide \| CHEMBL...) Show SMILES C[N+](C)(C)CCCCCC[N+](C)(C)C Show InChI	GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Similars	PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Curated by PDSP K_i Database									Mol Pharmacol 48: 280-7 (1995) BindingDB Entry DOI: 10.7270/Q2280648
Georgetown University Curated by PDSP K_i Database					More data for this Ligand-Target Pair
n-AChR (RAT)	BDBM50038416 ((1,6-trimethyl ammonium)hexane; dibromide \| CHEMBL...) Show SMILES C[N+](C)(C)CCCCCC[N+](C)(C)C Show InChI	GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Similars	PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by PDSP K_i Database									J Pharmacol Exp Ther 270: 159-66 (1994) BindingDB Entry DOI: 10.7270/Q22Z141C
University of California Curated by PDSP K_i Database					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-3 (Rattus norvegicus (Rat))	BDBM50038416 ((1,6-trimethyl ammonium)hexane; dibromide \| CHEMBL...) Show SMILES C[N+](C)(C)CCCCCC[N+](C)(C)C Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Curated by PDSP K_i Database									Mol Pharmacol 54: 322-33 (1998) Article DOI: 10.1124/mol.54.2.322 BindingDB Entry DOI: 10.7270/Q2ZW1JGJ
Georgetown University Curated by PDSP K_i Database					More data for this Ligand-Target Pair
n-AChR (RAT)	BDBM50038416 ((1,6-trimethyl ammonium)hexane; dibromide \| CHEMBL...) Show SMILES C[N+](C)(C)CCCCCC[N+](C)(C)C Show InChI	GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Curated by PDSP K_i Database									Mol Pharmacol 54: 322-33 (1998) Article DOI: 10.1124/mol.54.2.322 BindingDB Entry DOI: 10.7270/Q2ZW1JGJ
Georgetown University Curated by PDSP K_i Database					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4 (Homo sapiens (Human))	BDBM50038416 ((1,6-trimethyl ammonium)hexane; dibromide \| CHEMBL...) Show SMILES C[N+](C)(C)CCCCCC[N+](C)(C)C Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Similars	PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bath Curated by PDSP K_i Database									Mol Pharmacol 53: 950-62 (1998) BindingDB Entry DOI: 10.7270/Q2B856PT
University of Bath Curated by PDSP K_i Database					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4 (Homo sapiens (Human))	BDBM50038416 ((1,6-trimethyl ammonium)hexane; dibromide \| CHEMBL...) Show SMILES C[N+](C)(C)CCCCCC[N+](C)(C)C Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Similars	PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bath Curated by PDSP K_i Database									Mol Pharmacol 53: 950-62 (1998) BindingDB Entry DOI: 10.7270/Q2B856PT
University of Bath Curated by PDSP K_i Database					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4 (Homo sapiens (Human))	BDBM50038416 ((1,6-trimethyl ammonium)hexane; dibromide \| CHEMBL...) Show SMILES C[N+](C)(C)CCCCCC[N+](C)(C)C Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Barrow Neurological Institute Curated by PDSP K_i Database									Mol Pharmacol 64: 1283-94 (2003) Article DOI: 10.1124/mol.64.6.1283 BindingDB Entry DOI: 10.7270/Q2GF0S2V
Barrow Neurological Institute Curated by PDSP K_i Database					More data for this Ligand-Target Pair
Cholinergic, Nicotinic Alpha6 (Chick)	BDBM50038416 ((1,6-trimethyl ammonium)hexane; dibromide \| CHEMBL...) Show SMILES C[N+](C)(C)CCCCCC[N+](C)(C)C Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Milan Curated by PDSP K_i Database									Mol Pharmacol 63: 1329-37 (2003) Article DOI: 10.1124/mol.63.6.1329 BindingDB Entry DOI: 10.7270/Q29W0D27
University of Milan Curated by PDSP K_i Database					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit (Rattus norvegicus (Rat))	BDBM50038416 ((1,6-trimethyl ammonium)hexane; dibromide \| CHEMBL...) Show SMILES C[N+](C)(C)CCCCCC[N+](C)(C)C Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Similars	PubMed	2.17E+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) BindingDB Entry DOI: 10.7270/Q2Q81DNR
University of Kentucky Curated by ChEMBL					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor (Rattus norvegicus (Rat))	BDBM50038416 ((1,6-trimethyl ammonium)hexane; dibromide \| CHEMBL...) Show SMILES C[N+](C)(C)CCCCCC[N+](C)(C)C Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Similars	PubMed	>1.00E+5	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) BindingDB Entry DOI: 10.7270/Q2Q81DNR
University of Kentucky Curated by ChEMBL					More data for this Ligand-Target Pair
Acetylcholine receptor protein alpha/beta/delta/gamma chain (Torpedo californica)	BDBM50038416 ((1,6-trimethyl ammonium)hexane; dibromide \| CHEMBL...) Show SMILES C[N+](C)(C)CCCCCC[N+](C)(C)C Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	n/a
University of Toledo Curated by ChEMBL					Assay Description Compound was evaluated for the binding constant for association with nicotinic acetylcholine receptor (nAChR)				J Med Chem 37: 4417-20 (1995) Checked by Author BindingDB Entry DOI: 10.7270/Q24F1PS9
University of Toledo Curated by ChEMBL					More data for this Ligand-Target Pair