BDBM50039214 1-(2,3-Dihydro-1H-indol-5-yl)-3-[1-(4-methoxy-benzyl)-piperidin-4-yl]-propan-1-one::1-(indolin-5-yl)-3-(1-(4-methoxybenzyl)piperidin-4-yl)propan-1-one::CHEMBL76108

SMILES: COc1ccc(CN2CCC(CCC(=O)c3ccc4NCCc4c3)CC2)cc1

InChI Key: InChIKey=YSZGSTXOLOPIQO-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50039214   

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))	BDBM50039214 (1-(2,3-Dihydro-1H-indol-5-yl)-3-[1-(4-methoxy-benz...) Show SMILES COc1ccc(CN2CCC(CCC(=O)c3ccc4NCCc4c3)CC2)cc1 Show InChI InChI=1S/C24H30N2O2/c1-28-22-6-2-19(3-7-22)17-26-14-11-18(12-15-26)4-9-24(27)21-5-8-23-20(16-21)10-13-25-23/h2-3,5-8,16,18,25H,4,9-15,17H2,1H3	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	1.33E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sichuan University Curated by ChEMBL					Assay Description Inhibition of AChE				Eur J Med Chem 45: 1167-72 (2010) Article DOI: 10.1016/j.ejmech.2009.12.038 BindingDB Entry DOI: 10.7270/Q25H7GFM
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50039214 (1-(2,3-Dihydro-1H-indol-5-yl)-3-[1-(4-methoxy-benz...) Show SMILES COc1ccc(CN2CCC(CCC(=O)c3ccc4NCCc4c3)CC2)cc1 Show InChI InChI=1S/C24H30N2O2/c1-28-22-6-2-19(3-7-22)17-26-14-11-18(12-15-26)4-9-24(27)21-5-8-23-20(16-21)10-13-25-23/h2-3,5-8,16,18,25H,4,9-15,17H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.33E+4	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Chemical Industries, Ltd. Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase (AChE)				J Med Chem 37: 2292-9 (1994) BindingDB Entry DOI: 10.7270/Q2SX6C8G
					More data for this Ligand-Target Pair