Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Acetylcholinesterase' and Ligand = 'BDBM167907'   

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 (Rattus norvegicus (rat))	BDBM167907 (1-Pyrrolidinecarboxylic acid-4-(5,6,7-trihydroxy-4...) Show SMILES Oc1cc2oc(cc(=O)c2c(O)c1O)-c1ccc(OC(=O)N2CCCC2)cc1 Show InChI InChI=1S/C20H17NO7/c22-13-9-15(28-16-10-14(23)18(24)19(25)17(13)16)11-3-5-12(6-4-11)27-20(26)21-7-1-2-8-21/h3-6,9-10,23-25H,1-2,7-8H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.07E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sichuan University					Assay Description For rat AChE or BuChE inhibition assays, a reaction mixture (100 μL) containing acetylthiocholine iodide (1 mmol/L, 30 μL) (J&K Scientific)...				Chem Biol Drug Des 86: 1168-77 (2015) Article DOI: 10.1111/cbdd.12580 BindingDB Entry DOI: 10.7270/Q2VM4B1P
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