Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Acetylcholinesterase' and Ligand = 'BDBM50289104'   

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
Acetylcholinesterase (Homo sapiens (Human))	BDBM50289104 (2-Chloro-6,7,8,9,10,12-hexahydro-azepino[2,1-b]qui...) Show SMILES Clc1ccc2N=C3CCCCCN3Cc2c1 |t:5| Show InChI InChI=1S/C13H15ClN2/c14-11-5-6-12-10(8-11)9-16-7-3-1-2-4-13(16)15-12/h5-6,8H,1-4,7,9H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory activity against acetylcholinesterase in human RBC				Bioorg Med Chem Lett 6: 737-742 (1996) Article DOI: 10.1016/0960-894X(96)00102-3 BindingDB Entry DOI: 10.7270/Q2736RDK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50289104 (2-Chloro-6,7,8,9,10,12-hexahydro-azepino[2,1-b]qui...) Show SMILES Clc1ccc2N=C3CCCCCN3Cc2c1 |t:5| Show InChI InChI=1S/C13H15ClN2/c14-11-5-6-12-10(8-11)9-16-7-3-1-2-4-13(16)15-12/h5-6,8H,1-4,7,9H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	9.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory activity against acetylcholinesterase in rat brain				Bioorg Med Chem Lett 6: 737-742 (1996) Article DOI: 10.1016/0960-894X(96)00102-3 BindingDB Entry DOI: 10.7270/Q2736RDK
					More data for this Ligand-Target Pair