BDBM50307921 (E,E)-1,3-bis[4-[[(2,6-dichlorobenzyloxyl)imino]methyl]pyridinium]propane. dibromide::1,1'-(propane-1,3-diyl)bis(4-((2,6-dichlorobenzyloxyimino)methyl)pyridinium)bromide::CHEMBL590603
SMILES: Clc1cccc(Cl)c1CO\N=C\c1cc[n+](CCC[n+]2ccc(\C=N\OCc3c(Cl)cccc3Cl)cc2)cc1
InChI Key: InChIKey=RAHLDBGBLYIYDN-WKCPDWHCSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Acetylcholinesterase (Electrophorus electricus (Electric eel)) | BDBM50307921 ((E,E)-1,3-bis[4-[[(2,6-dichlorobenzyloxyl)imino]me...) | UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 340 | n/a | n/a | n/a | n/a | n/a | n/a |
Ege-University Curated by ChEMBL | Assay Description Inhibition of electric eel AChE by modified Ellman's method | Bioorg Med Chem 18: 2049-59 (2010) Article DOI: 10.1016/j.bmc.2010.01.002 BindingDB Entry DOI: 10.7270/Q2GH9J3H | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Acetylcholinesterase (Homo sapiens (Human)) | BDBM50307921 ((E,E)-1,3-bis[4-[[(2,6-dichlorobenzyloxyl)imino]me...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 6.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bologna Curated by ChEMBL | Assay Description Inhibition of human AchE | J Med Chem 51: 347-72 (2008) Article DOI: 10.1021/jm7009364 BindingDB Entry DOI: 10.7270/Q25B039W | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cholinergic, muscarinic (GUINEA PIG) | BDBM50307921 ((E,E)-1,3-bis[4-[[(2,6-dichlorobenzyloxyl)imino]me...) | PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | n/a | n/a | 4.70E+3 | n/a | n/a | n/a | n/a |
University of Bonn Curated by ChEMBL | Assay Description Reduction of dissociation rate of [3H]N-methylscopolamine ([3H]NMS) from muscarinic acetylcholne receptor M2 of pig heart | J Med Chem 37: 1439-45 (1994) BindingDB Entry DOI: 10.7270/Q22F7P30 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Butyrylcholinesterase (BuChE) (Equus caballus (Horse)) | BDBM50307921 ((E,E)-1,3-bis[4-[[(2,6-dichlorobenzyloxyl)imino]me...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 1.83E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Ege-University Curated by ChEMBL | Assay Description Inhibition of horse serum BuChE by modified Ellman's method | Bioorg Med Chem 18: 2049-59 (2010) Article DOI: 10.1016/j.bmc.2010.01.002 BindingDB Entry DOI: 10.7270/Q2GH9J3H | |||||||||||
More data for this Ligand-Target Pair |