BDBM50009667 CHEMBL3235224

SMILES: O\N=C\C(=O)c1ccc(OCC2CCN(Cc3ccc(F)c(F)c3)CC2)nc1

InChI Key: InChIKey=ORJMJWOJTHTRBC-BHGWPJFGSA-N

Data: 1 KI

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 1 hit for monomerid = 50009667   

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))	BDBM50009667 (CHEMBL3235224) Show SMILES O\N=C\C(=O)c1ccc(OCC2CCN(Cc3ccc(F)c(F)c3)CC2)nc1 Show InChI InChI=1S/C20H21F2N3O3/c21-17-3-1-15(9-18(17)22)12-25-7-5-14(6-8-25)13-28-20-4-2-16(10-23-20)19(26)11-24-27/h1-4,9-11,14,27H,5-8,12-13H2/b24-11+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	1.59E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Southwest Research Institute Curated by ChEMBL					Assay Description Inhibition of human AChE using acetylthiocholine as substrate after 4 hrs by robotic spectrophotometric assay				Bioorg Med Chem Lett 24: 1711-4 (2014) Article DOI: 10.1016/j.bmcl.2014.02.049 BindingDB Entry DOI: 10.7270/Q280545W
					More data for this Ligand-Target Pair