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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cholinesterase' and Ligand = 'BDBM50221066'   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Cholinesterase


(Equus caballus (Horse))		BDBM50221066
PNG
((-)-lycorine | 9,10-(methylenedioxy)-3,12-didehydr...)
Show SMILES O[C@H]1C=C2CCN3Cc4cc5OCOc5cc4[C@@H]([C@@H]23)[C@@H]1O |r,t:2|
Show InChI InChI=1S/C16H17NO4/c18-11-3-8-1-2-17-6-9-4-12-13(21-7-20-12)5-10(9)14(15(8)17)16(11)19/h3-5,11,14-16,18-19H,1-2,6-7H2/t11-,14-,15+,16+/m0/s1
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Article
PubMed
n/an/a>2.00E+5n/an/an/an/an/an/a



Universidad Nacional de San Juan

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE using ATCI as substrate preincubated for 30 mins followed by substrate addition measured after 5 mins by DTNB-based ...

J Nat Prod 79: 1241-8 (2016)


Article DOI: 10.1021/acs.jnatprod.5b00785
BindingDB Entry DOI: 10.7270/Q2WM1GBJ
More data for this
Ligand-Target Pair