BDBM50520711 CHEMBL4579917

SMILES: Clc1cccc(CC2(COc3ccncc3)CCCNC2)c1

InChI Key: InChIKey=NIOWNQMDKDMUGQ-UHFFFAOYSA-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 = 50520711   

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
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50520711 (CHEMBL4579917) Show SMILES Clc1cccc(CC2(COc3ccncc3)CCCNC2)c1 Show InChI InChI=1S/C18H21ClN2O/c19-16-4-1-3-15(11-16)12-18(7-2-8-21-13-18)14-22-17-5-9-20-10-6-17/h1,3-6,9-11,21H,2,7-8,12-14H2	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of [3H]epibatidine from Lymnaea stagnalis acetylcholine-binding protein incubated for 60 mins followed by 3 hrs incubation in dark condi...				Eur J Med Chem 160: 37-48 (2018) Article DOI: 10.1016/j.ejmech.2018.09.073
					More data for this Ligand-Target Pair