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BDBM50330758 CHEMBL1277682::isomammeigin

SMILES: CC(C)CC(=O)c1c(O)c2C=CC(C)(C)Oc2c2c(cc(=O)oc12)-c1ccccc1

InChI Key: InChIKey=DJKBNLZZTMVBGL-UHFFFAOYSA-N

Data: 1 IC50

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Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50330758   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50330758
PNG
(CHEMBL1277682 | isomammeigin)
Show SMILES CC(C)CC(=O)c1c(O)c2C=CC(C)(C)Oc2c2c(cc(=O)oc12)-c1ccccc1
Show InChI InChI=1S/C25H24O5/c1-14(2)12-18(26)21-22(28)16-10-11-25(3,4)30-23(16)20-17(13-19(27)29-24(20)21)15-8-6-5-7-9-15/h5-11,13-14,28H,12H2,1-4H3
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



University of Malaya

Curated by ChEMBL


Assay Description
Inhibition of Electrophorus electricus AChE after 120 secs by Ellman spectroscopic method


Bioorg Med Chem 18: 7873-7 (2010)


Article DOI: 10.1016/j.bmc.2010.09.044
BindingDB Entry DOI: 10.7270/Q2B27VH4
More data for this
Ligand-Target Pair