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SMILES: Cc1cc(=O)oc2c1ccc1oc(=N)c(cc21)C(=O)NC1CC1

InChI Key: InChIKey=OJQOOEGPIAPNKX-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50500452   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cholinesterase


(Equus caballus (Horse))
BDBM50500452
PNG
(CHEMBL3746215)
Show SMILES Cc1cc(=O)oc2c1ccc1oc(=N)c(cc21)C(=O)NC1CC1
Show InChI InChI=1S/C17H14N2O4/c1-8-6-14(20)23-15-10(8)4-5-13-11(15)7-12(16(18)22-13)17(21)19-9-2-3-9/h4-7,9,18H,2-3H2,1H3,(H,19,21)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.89E+4n/an/an/an/an/an/a



Yogi Vemana University

Curated by ChEMBL


Assay Description
Inhibition of horse serum butyrylcholinesterase using butyrylthiocholine iodide as substrate preincubated for 5 mins followed by substrate addition m...


Eur J Med Chem 107: 219-32 (2016)


Article DOI: 10.1016/j.ejmech.2015.10.046
BindingDB Entry DOI: 10.7270/Q2JW8HWF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50500452
PNG
(CHEMBL3746215)
Show SMILES Cc1cc(=O)oc2c1ccc1oc(=N)c(cc21)C(=O)NC1CC1
Show InChI InChI=1S/C17H14N2O4/c1-8-6-14(20)23-15-10(8)4-5-13-11(15)7-12(16(18)22-13)17(21)19-9-2-3-9/h4-7,9,18H,2-3H2,1H3,(H,19,21)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 910n/an/an/an/an/an/a



Yogi Vemana University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 5 mins followed by substrate addition measured after 5 m...


Eur J Med Chem 107: 219-32 (2016)


Article DOI: 10.1016/j.ejmech.2015.10.046
BindingDB Entry DOI: 10.7270/Q2JW8HWF
More data for this
Ligand-Target Pair