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
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 |
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Neuronal acetylcholine receptor (Rattus norvegicus (Rat)) | BDBM50119796![]() (1,1'-(hexane-1,6-diyl)diquinolinium iodide | 1,6-d...) | PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar | 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...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar | 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 | |||||||||||||
Cholinesterases (Homo sapiens (Human)) | BDBM50119796![]() (1,1'-(hexane-1,6-diyl)diquinolinium iodide | 1,6-d...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar | 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 | |||||||||||||
Cholinesterases (Homo sapiens (Human)) | BDBM50119796![]() (1,1'-(hexane-1,6-diyl)diquinolinium iodide | 1,6-d...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar | 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 |