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SMILES: CCOCCn1c(nc2ccccc12)C1CCCN(C1)C1CCOCC1

InChI Key: InChIKey=WQOMZYPBVOXQJY-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50316925   

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
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50316925 (2-(1-cyclohexylpiperidin-3-yl)-1-(2-ethoxyethyl)-1...) Show SMILES CCOCCn1c(nc2ccccc12)C1CCCN(C1)C1CCOCC1 Show InChI InChI=1S/C21H31N3O2/c1-2-25-15-12-24-20-8-4-3-7-19(20)22-21(24)17-6-5-11-23(16-17)18-9-13-26-14-10-18/h3-4,7-8,17-18H,2,5-6,9-16H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences Curated by ChEMBL					Assay Description Displacement of [3H]dofetolide from human ERG channel expressed in HEK293 cells by liquid scintillation counting				Bioorg Med Chem Lett 20: 2916-9 (2010) Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Homo sapiens (Human))	BDBM50316925 (2-(1-cyclohexylpiperidin-3-yl)-1-(2-ethoxyethyl)-1...) Show SMILES CCOCCn1c(nc2ccccc12)C1CCCN(C1)C1CCOCC1 Show InChI InChI=1S/C21H31N3O2/c1-2-25-15-12-24-20-8-4-3-7-19(20)22-21(24)17-6-5-11-23(16-17)18-9-13-26-14-10-18/h3-4,7-8,17-18H,2,5-6,9-16H2,1H3	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	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences Curated by ChEMBL					Assay Description Inhibition of CYP3A4				Bioorg Med Chem Lett 20: 2916-9 (2010) Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0
					More data for this Ligand-Target Pair