null

SMILES: C(CCCN(Cc1cc2ccccc2o1)Cc1cc2ccccc2o1)CCNc1c2CCCc2nc2ccccc12

InChI Key: InChIKey=BWWUAZJYGRIHDC-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50138450   

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))	BDBM50138450 (CHEMBL3754341) Show SMILES C(CCCN(Cc1cc2ccccc2o1)Cc1cc2ccccc2o1)CCNc1c2CCCc2nc2ccccc12 Show InChI InChI=1S/C36H37N3O2/c1(9-20-37-36-30-14-5-6-16-32(30)38-33-17-11-15-31(33)36)2-10-21-39(24-28-22-26-12-3-7-18-34(26)40-28)25-29-23-27-13-4-8-19-35(27)41-29/h3-8,12-14,16,18-19,22-23H,1-2,9-11,15,17,20-21,24-25H2,(H,37,38)	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	2.07E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant human AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition by Ellman's ...				J Med Chem 59: 114-31 (2016) Article DOI: 10.1021/acs.jmedchem.5b01119 BindingDB Entry DOI: 10.7270/Q2S75J5X
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50138450 (CHEMBL3754341) Show SMILES C(CCCN(Cc1cc2ccccc2o1)Cc1cc2ccccc2o1)CCNc1c2CCCc2nc2ccccc12 Show InChI InChI=1S/C36H37N3O2/c1(9-20-37-36-30-14-5-6-16-32(30)38-33-17-11-15-31(33)36)2-10-21-39(24-28-22-26-12-3-7-18-34(26)40-28)25-29-23-27-13-4-8-19-35(27)41-29/h3-8,12-14,16,18-19,22-23H,1-2,9-11,15,17,20-21,24-25H2,(H,37,38)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.90	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition by Ellman's metho...				J Med Chem 59: 114-31 (2016) Article DOI: 10.1021/acs.jmedchem.5b01119 BindingDB Entry DOI: 10.7270/Q2S75J5X
					More data for this Ligand-Target Pair