Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Acetylcholinesterase' and Ligand = 'BDBM185736'   

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))	BDBM185736 (US9162983, A) Show SMILES CN(CCc1ccccc1)C1CCc2ncc(NC(=O)C(=N\O)\C(C)=O)cc2C1 Show InChI InChI=1S/C22H26N4O3/c1-15(27)21(25-29)22(28)24-18-12-17-13-19(8-9-20(17)23-14-18)26(2)11-10-16-6-4-3-5-7-16/h3-7,12,14,19,29H,8-11,13H2,1-2H3,(H,24,28)/b25-21+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.11E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SOUTHWEST RESEARCH INSTITUTE US Patent					Assay Description Accordingly Ki is for uninhibited AChE. The higher the number, the less the native enzyme is inhibited by the reactivator compound, which is what one...				US Patent US9162983 (2015) BindingDB Entry DOI: 10.7270/Q2057DQC
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