Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Choline O-acetyltransferase' and Ligand = 'BDBM50280246'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Choline O-acetyltransferase (Gallus gallus)	BDBM50280246 (4-((E)-2-Naphthalen-1-yl-vinyl)-1-propyl-pyridiniu...) Show SMILES CCC[n+]1ccc(\C=C\c2cccc3ccccc23)cc1 Show InChI InChI=1S/C20H20N/c1-2-14-21-15-12-17(13-16-21)10-11-19-8-5-7-18-6-3-4-9-20(18)19/h3-13,15-16H,2,14H2,1H3/q+1/b11-10+	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested in vitro for inhibitory activity against chick optic lobe choline acetyltransferase (ChAT)				Bioorg Med Chem Lett 2: 1493-1496 (1992) Article DOI: 10.1016/S0960-894X(00)80415-1 BindingDB Entry DOI: 10.7270/Q2QN66PD
					More data for this Ligand-Target Pair
Choline O-acetyltransferase (RAT)	BDBM50280246 (4-((E)-2-Naphthalen-1-yl-vinyl)-1-propyl-pyridiniu...) Show SMILES CCC[n+]1ccc(\C=C\c2cccc3ccccc23)cc1 Show InChI InChI=1S/C20H20N/c1-2-14-21-15-12-17(13-16-21)10-11-19-8-5-7-18-6-3-4-9-20(18)19/h3-13,15-16H,2,14H2,1H3/q+1/b11-10+	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested in vitro for inhibitory activity against rat choline acetyltransferase (ChAT)				Bioorg Med Chem Lett 2: 1493-1496 (1992) Article DOI: 10.1016/S0960-894X(00)80415-1 BindingDB Entry DOI: 10.7270/Q2QN66PD
					More data for this Ligand-Target Pair
Choline O-acetyltransferase (Gallus gallus)	BDBM50280246 (4-((E)-2-Naphthalen-1-yl-vinyl)-1-propyl-pyridiniu...) Show SMILES CCC[n+]1ccc(\C=C\c2cccc3ccccc23)cc1 Show InChI InChI=1S/C20H20N/c1-2-14-21-15-12-17(13-16-21)10-11-19-8-5-7-18-6-3-4-9-20(18)19/h3-13,15-16H,2,14H2,1H3/q+1/b11-10+	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	5.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested in vitro for inhibitory activity against chick choline acetyltransferase (ChAT)				Bioorg Med Chem Lett 2: 1493-1496 (1992) Article DOI: 10.1016/S0960-894X(00)80415-1 BindingDB Entry DOI: 10.7270/Q2QN66PD
					More data for this Ligand-Target Pair