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BDBM50340112 CHEMBL1762830::rac-14-(2'-Methoxyphenyl)-10,11,12,14-tetrahydro-9H-benzo[5,6]chromeno[2,3-b]quinolin-13-amine

SMILES: COc1ccccc1C1c2c(N)c3CCCCc3nc2Oc2ccc3ccccc3c12

InChI Key: InChIKey=QVGAOTIUMFMLBN-UHFFFAOYSA-N

Data: 2 IC50

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 = 50340112   
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
Butyrylcholinesterase (BuChE)


(Equus caballus (Horse))
BDBM50340112
PNG
(CHEMBL1762830 | rac-14-(2'-Methoxyphenyl)-10,11,12...)
Show SMILES COc1ccccc1C1c2c(N)c3CCCCc3nc2Oc2ccc3ccccc3c12
Show InChI InChI=1S/C27H24N2O2/c1-30-21-13-7-5-11-19(21)24-23-17-9-3-2-8-16(17)14-15-22(23)31-27-25(24)26(28)18-10-4-6-12-20(18)29-27/h2-3,5,7-9,11,13-15,24H,4,6,10,12H2,1H3,(H2,28,29)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ de Sfax

Curated by ChEMBL


Assay Description
Inhibition of horse serum butrylcholinesterase preincubated with compound for 10 mins using butrylcholine iodide as substrate after 15 mins by spectr...


Bioorg Med Chem Lett 21: 2384-8 (2011)


Article DOI: 10.1016/j.bmcl.2011.02.094
BindingDB Entry DOI: 10.7270/Q2D79BQQ
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50340112
PNG
(CHEMBL1762830 | rac-14-(2'-Methoxyphenyl)-10,11,12...)
Show SMILES COc1ccccc1C1c2c(N)c3CCCCc3nc2Oc2ccc3ccccc3c12
Show InChI InChI=1S/C27H24N2O2/c1-30-21-13-7-5-11-19(21)24-23-17-9-3-2-8-16(17)14-15-22(23)31-27-25(24)26(28)18-10-4-6-12-20(18)29-27/h2-3,5,7-9,11,13-15,24H,4,6,10,12H2,1H3,(H2,28,29)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 20n/an/an/an/an/an/a



Universit£ de Sfax

Curated by ChEMBL


Assay Description
Inhibition of Electrophorus electricus acetylcholinesterase preincubated with compound for 10 mins using acetylcholine iodide as substrate after 15 m...


Bioorg Med Chem Lett 21: 2384-8 (2011)


Article DOI: 10.1016/j.bmcl.2011.02.094
BindingDB Entry DOI: 10.7270/Q2D79BQQ
More data for this
Ligand-Target Pair