BDBM50139053 CHEMBL3752227
SMILES: CCN(CCCCCCCCc1cccc(OC)c1)Cc1ccccc1OC
InChI Key: InChIKey=CPIHZFXHCABWRY-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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Acetylcholinesterase (Electrophorus electricus (Electric eel)) | BDBM50139053 (CHEMBL3752227) | UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 2.44E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bras£lia Curated by ChEMBL | Assay Description Non-competitive inhibition of electric eel acetylcholine esterase using acetylcholine iodide as substrate by Ellman's method | Eur J Med Chem 108: 687-700 (2016) BindingDB Entry DOI: 10.7270/Q20R9R7V | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Butyrylcholinesterase (BuChE) (Equus caballus (Horse)) | BDBM50139053 (CHEMBL3752227) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bras£lia Curated by ChEMBL | Assay Description Inhibition of horse butyrylcholine esterase preincubated for 10 mins followed by the addition of butyrylcholine iodide as substrate measured after 5 ... | Eur J Med Chem 108: 687-700 (2016) BindingDB Entry DOI: 10.7270/Q20R9R7V | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Acetylcholinesterase (Electrophorus electricus (Electric eel)) | BDBM50139053 (CHEMBL3752227) | UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 6.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bras£lia Curated by ChEMBL | Assay Description Inhibition of electric eel acetylcholine esterase preincubated for 10 mins followed by the addition of acetylcholine iodide as substrate measured aft... | Eur J Med Chem 108: 687-700 (2016) BindingDB Entry DOI: 10.7270/Q20R9R7V | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Acetylcholinesterase (Homo sapiens (Human)) | BDBM50139053 (CHEMBL3752227) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 5.65E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bras£lia Curated by ChEMBL | Assay Description Inhibition of human acetylcholine esterase preincubated for 10 mins followed by the addition of 550 uM of acetylcholine iodide as substrate measured ... | Eur J Med Chem 108: 687-700 (2016) BindingDB Entry DOI: 10.7270/Q20R9R7V | |||||||||||
More data for this Ligand-Target Pair |