BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 45 hits Enz. Inhib. hit(s) with all data for entry = 50002874   
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))
BDBM50464028
PNG
(CHEMBL4241164)
Show SMILES [Cl-].Clc1ccc(C[n+]2cccc(Cn3c4ccccc4c4ccccc34)c2)cc1
Show InChI InChI=1S/C25H20ClN2/c26-21-13-11-19(12-14-21)16-27-15-5-6-20(17-27)18-28-24-9-3-1-7-22(24)23-8-2-4-10-25(23)28/h1-15,17H,16,18H2/q+1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
90n/an/an/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Mixed-type inhibition of equine serum BuChE using varying levels of butyrylthiocholine iodide as substrate preincubated for 10 mins followed by subst...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM8960
PNG
((+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimet...)
Show SMILES COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC
Show InChI InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3
UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MCE
PC cid
PC sid
PDB
UniChem

Patents


Similars

Article
PubMed
n/an/a 23n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 mi...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50464028
PNG
(CHEMBL4241164)
Show SMILES [Cl-].Clc1ccc(C[n+]2cccc(Cn3c4ccccc4c4ccccc34)c2)cc1
Show InChI InChI=1S/C25H20ClN2/c26-21-13-11-19(12-14-21)16-27-15-5-6-20(17-27)18-28-24-9-3-1-7-22(24)23-8-2-4-10-25(23)28/h1-15,17H,16,18H2/q+1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 73n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 ...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50464019
PNG
(CHEMBL4245106)
Show SMILES [Cl-].Cc1ccc(C[n+]2cccc(Cn3c4ccccc4c4ccccc34)c2)cc1
Show InChI InChI=1S/C26H23N2/c1-20-12-14-21(15-13-20)17-27-16-6-7-22(18-27)19-28-25-10-4-2-8-23(25)24-9-3-5-11-26(24)28/h2-16,18H,17,19H2,1H3/q+1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 110n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 ...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50464031
PNG
(CHEMBL4248896)
Show SMILES [Br-].Fc1ccc(C[n+]2cccc(Cn3c4ccccc4c4ccccc34)c2)cc1
Show InChI InChI=1S/C25H20FN2/c26-21-13-11-19(12-14-21)16-27-15-5-6-20(17-27)18-28-24-9-3-1-7-22(24)23-8-2-4-10-25(23)28/h1-15,17H,16,18H2/q+1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 130n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 ...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50464025
PNG
(CHEMBL4244170)
Show SMILES [Br-].Clc1cccc(C[n+]2cccc(Cn3c4ccccc4c4ccccc34)c2)c1
Show InChI InChI=1S/C25H20ClN2/c26-21-9-5-7-19(15-21)16-27-14-6-8-20(17-27)18-28-24-12-3-1-10-22(24)23-11-2-4-13-25(23)28/h1-15,17H,16,18H2/q+1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 160n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 ...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50464021
PNG
(CHEMBL4241338)
Show SMILES [Br-].Cc1ccccc1C[n+]1cccc(Cn2c3ccccc3c3ccccc23)c1
Show InChI InChI=1S/C26H23N2/c1-20-9-2-3-11-22(20)19-27-16-8-10-21(17-27)18-28-25-14-6-4-12-23(25)24-13-5-7-15-26(24)28/h2-17H,18-19H2,1H3/q+1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 220n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 ...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50464029
PNG
(CHEMBL4242583)
Show SMILES [Br-].C(c1ccc[n+](Cc2ccccc2)c1)n1c2ccccc2c2ccccc12
Show InChI InChI=1S/C25H21N2/c1-2-9-20(10-3-1)17-26-16-8-11-21(18-26)19-27-24-14-6-4-12-22(24)23-13-5-7-15-25(23)27/h1-16,18H,17,19H2/q+1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 270n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 ...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50464030
PNG
(CHEMBL4244620)
Show SMILES [Cl-].Cc1cccc(C[n+]2cccc(Cn3c4ccccc4c4ccccc34)c2)c1
Show InChI InChI=1S/C26H23N2/c1-20-8-6-9-21(16-20)17-27-15-7-10-22(18-27)19-28-25-13-4-2-11-23(25)24-12-3-5-14-26(24)28/h2-16,18H,17,19H2,1H3/q+1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 280n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 ...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50464027
PNG
(CHEMBL4243615)
Show SMILES [Br-].Cc1ccccc1C[n+]1ccc(Cn2c3ccccc3c3ccccc23)cc1
Show InChI InChI=1S/C26H23N2/c1-20-8-2-3-9-22(20)19-27-16-14-21(15-17-27)18-28-25-12-6-4-10-23(25)24-11-5-7-13-26(24)28/h2-17H,18-19H2,1H3/q+1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 350n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 ...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM8960
PNG
((+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimet...)
Show SMILES COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC
Show InChI InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MCE
PC cid
PC sid
PDB
UniChem

Patents


Similars

Article
PubMed
n/an/a 350n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 ...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50464026
PNG
(CHEMBL4240662)
Show SMILES [Br-].Clc1cccc(C[n+]2ccc(Cn3c4ccccc4c4ccccc34)cc2)c1
Show InChI InChI=1S/C25H20ClN2/c26-21-7-5-6-20(16-21)17-27-14-12-19(13-15-27)18-28-24-10-3-1-8-22(24)23-9-2-4-11-25(23)28/h1-16H,17-18H2/q+1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 350n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 ...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50464017
PNG
(CHEMBL4247756)
Show SMILES [Cl-].Fc1ccccc1C[n+]1cccc(Cn2c3ccccc3c3ccccc23)c1
Show InChI InChI=1S/C25H20FN2/c26-23-12-4-1-9-20(23)18-27-15-7-8-19(16-27)17-28-24-13-5-2-10-21(24)22-11-3-6-14-25(22)28/h1-16H,17-18H2/q+1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 370n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 ...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50464022
PNG
(CHEMBL4244767)
Show SMILES [Cl-].Clc1ccccc1C[n+]1cccc(Cn2c3ccccc3c3ccccc23)c1
Show InChI InChI=1S/C25H20ClN2/c26-23-12-4-1-9-20(23)18-27-15-7-8-19(16-27)17-28-24-13-5-2-10-21(24)22-11-3-6-14-25(22)28/h1-16H,17-18H2/q+1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 380n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 ...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50464034
PNG
(CHEMBL4251230)
Show SMILES [Br-].C(c1cc[n+](Cc2ccccc2)cc1)n1c2ccccc2c2ccccc12
Show InChI InChI=1S/C25H21N2/c1-2-8-20(9-3-1)18-26-16-14-21(15-17-26)19-27-24-12-6-4-10-22(24)23-11-5-7-13-25(23)27/h1-17H,18-19H2/q+1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 580n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 ...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50464033
PNG
(CHEMBL4250760)
Show SMILES [Cl-].Clc1ccccc1C[n+]1ccc(Cn2c3ccccc3c3ccccc23)cc1
Show InChI InChI=1S/C25H20ClN2/c26-23-10-4-1-7-20(23)18-27-15-13-19(14-16-27)17-28-24-11-5-2-8-21(24)22-9-3-6-12-25(22)28/h1-16H,17-18H2/q+1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 590n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 ...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50464018
PNG
(CHEMBL4239674)
Show SMILES [Cl-].Fc1ccccc1C[n+]1ccc(Cn2c3ccccc3c3ccccc23)cc1
Show InChI InChI=1S/C25H20FN2/c26-23-10-4-1-7-20(23)18-27-15-13-19(14-16-27)17-28-24-11-5-2-8-21(24)22-9-3-6-12-25(22)28/h1-16H,17-18H2/q+1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 670n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 ...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50464020
PNG
(CHEMBL4243151)
Show SMILES [Cl-].Cc1cccc(C[n+]2ccc(Cn3c4ccccc4c4ccccc34)cc2)c1
Show InChI InChI=1S/C26H23N2/c1-20-7-6-8-22(17-20)18-27-15-13-21(14-16-27)19-28-25-11-4-2-9-23(25)24-10-3-5-12-26(24)28/h2-17H,18-19H2,1H3/q+1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 730n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 ...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50464036
PNG
(CHEMBL4240265)
Show SMILES [Br-].Fc1cccc(C[n+]2cccc(Cn3c4ccccc4c4ccccc34)c2)c1
Show InChI InChI=1S/C25H20FN2/c26-21-9-5-7-19(15-21)16-27-14-6-8-20(17-27)18-28-24-12-3-1-10-22(24)23-11-2-4-13-25(23)28/h1-15,17H,16,18H2/q+1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 750n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 ...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50464032
PNG
(CHEMBL4247394)
Show SMILES [Cl-].Cc1ccc(C[n+]2ccc(Cn3c4ccccc4c4ccccc34)cc2)cc1
Show InChI InChI=1S/C26H23N2/c1-20-10-12-21(13-11-20)18-27-16-14-22(15-17-27)19-28-25-8-4-2-6-23(25)24-7-3-5-9-26(24)28/h2-17H,18-19H2,1H3/q+1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 810n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 ...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50464024
PNG
(CHEMBL4246944)
Show SMILES [Cl-].Fc1ccc(C[n+]2ccc(Cn3c4ccccc4c4ccccc34)cc2)cc1
Show InChI InChI=1S/C25H20FN2/c26-21-11-9-19(10-12-21)17-27-15-13-20(14-16-27)18-28-24-7-3-1-5-22(24)23-6-2-4-8-25(23)28/h1-16H,17-18H2/q+1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 890n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 ...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50464035
PNG
(CHEMBL4249779)
Show SMILES [Cl-].Fc1cccc(C[n+]2ccc(Cn3c4ccccc4c4ccccc34)cc2)c1
Show InChI InChI=1S/C25H20FN2/c26-21-7-5-6-20(16-21)17-27-14-12-19(13-15-27)18-28-24-10-3-1-8-22(24)23-9-2-4-11-25(23)28/h1-16H,17-18H2/q+1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.10E+3n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 ...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50464023
PNG
(CHEMBL4239383)
Show SMILES [Cl-].Clc1ccc(C[n+]2ccc(Cn3c4ccccc4c4ccccc34)cc2)cc1
Show InChI InChI=1S/C25H20ClN2/c26-21-11-9-19(10-12-21)17-27-15-13-20(14-16-27)18-28-24-7-3-1-5-22(24)23-6-2-4-8-25(23)28/h1-16H,17-18H2/q+1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.60E+3n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 ...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM10404
PNG
((1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetrac...)
Show SMILES COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 |r,c:12|
Show InChI InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

Article
PubMed
n/an/a 1.70E+3n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 mi...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50464033
PNG
(CHEMBL4250760)
Show SMILES [Cl-].Clc1ccccc1C[n+]1ccc(Cn2c3ccccc3c3ccccc23)cc1
Show InChI InChI=1S/C25H20ClN2/c26-23-10-4-1-7-20(23)18-27-15-13-19(14-16-27)17-28-24-11-5-2-8-21(24)22-9-3-6-12-25(22)28/h1-16H,17-18H2/q+1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6.80E+3n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 mi...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50464026
PNG
(CHEMBL4240662)
Show SMILES [Br-].Clc1cccc(C[n+]2ccc(Cn3c4ccccc4c4ccccc34)cc2)c1
Show InChI InChI=1S/C25H20ClN2/c26-21-7-5-6-20(16-21)17-27-14-12-19(13-15-27)18-28-24-10-3-1-8-22(24)23-9-2-4-11-25(23)28/h1-16H,17-18H2/q+1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 9.30E+3n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 mi...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM10404
PNG
((1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetrac...)
Show SMILES COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 |r,c:12|
Show InChI InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

Article
PubMed
n/an/a 9.40E+3n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 ...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50464027
PNG
(CHEMBL4243615)
Show SMILES [Br-].Cc1ccccc1C[n+]1ccc(Cn2c3ccccc3c3ccccc23)cc1
Show InChI InChI=1S/C26H23N2/c1-20-8-2-3-9-22(20)19-27-16-14-21(15-17-27)18-28-25-12-6-4-10-23(25)24-11-5-7-13-26(24)28/h2-17H,18-19H2,1H3/q+1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.19E+4n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 mi...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50464018
PNG
(CHEMBL4239674)
Show SMILES [Cl-].Fc1ccccc1C[n+]1ccc(Cn2c3ccccc3c3ccccc23)cc1
Show InChI InChI=1S/C25H20FN2/c26-23-10-4-1-7-20(23)18-27-15-13-19(14-16-27)17-28-24-11-5-2-8-21(24)22-9-3-6-12-25(22)28/h1-16H,17-18H2/q+1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.27E+4n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 mi...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50464034
PNG
(CHEMBL4251230)
Show SMILES [Br-].C(c1cc[n+](Cc2ccccc2)cc1)n1c2ccccc2c2ccccc12
Show InChI InChI=1S/C25H21N2/c1-2-8-20(9-3-1)18-26-16-14-21(15-17-26)19-27-24-12-6-4-10-22(24)23-11-5-7-13-25(23)27/h1-17H,18-19H2/q+1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.28E+4n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 mi...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50464032
PNG
(CHEMBL4247394)
Show SMILES [Cl-].Cc1ccc(C[n+]2ccc(Cn3c4ccccc4c4ccccc34)cc2)cc1
Show InChI InChI=1S/C26H23N2/c1-20-10-12-21(13-11-20)18-27-16-14-22(15-17-27)19-28-25-8-4-2-6-23(25)24-7-3-5-9-26(24)28/h2-17H,18-19H2,1H3/q+1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.56E+4n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 mi...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50464020
PNG
(CHEMBL4243151)
Show SMILES [Cl-].Cc1cccc(C[n+]2ccc(Cn3c4ccccc4c4ccccc34)cc2)c1
Show InChI InChI=1S/C26H23N2/c1-20-7-6-8-22(17-20)18-27-15-13-21(14-16-27)19-28-25-11-4-2-9-23(25)24-10-3-5-12-26(24)28/h2-17H,18-19H2,1H3/q+1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.75E+4n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 mi...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50464024
PNG
(CHEMBL4246944)
Show SMILES [Cl-].Fc1ccc(C[n+]2ccc(Cn3c4ccccc4c4ccccc34)cc2)cc1
Show InChI InChI=1S/C25H20FN2/c26-21-11-9-19(10-12-21)17-27-15-13-20(14-16-27)18-28-24-7-3-1-5-22(24)23-6-2-4-8-25(23)28/h1-16H,17-18H2/q+1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.88E+4n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 mi...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50464023
PNG
(CHEMBL4239383)
Show SMILES [Cl-].Clc1ccc(C[n+]2ccc(Cn3c4ccccc4c4ccccc34)cc2)cc1
Show InChI InChI=1S/C25H20ClN2/c26-21-11-9-19(10-12-21)17-27-15-13-20(14-16-27)18-28-24-7-3-1-5-22(24)23-6-2-4-8-25(23)28/h1-16H,17-18H2/q+1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.91E+4n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 mi...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50464028
PNG
(CHEMBL4241164)
Show SMILES [Cl-].Clc1ccc(C[n+]2cccc(Cn3c4ccccc4c4ccccc34)c2)cc1
Show InChI InChI=1S/C25H20ClN2/c26-21-13-11-19(12-14-21)16-27-15-5-6-20(17-27)18-28-24-9-3-1-7-22(24)23-8-2-4-10-25(23)28/h1-15,17H,16,18H2/q+1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.00E+4n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 mi...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50464035
PNG
(CHEMBL4249779)
Show SMILES [Cl-].Fc1cccc(C[n+]2ccc(Cn3c4ccccc4c4ccccc34)cc2)c1
Show InChI InChI=1S/C25H20FN2/c26-21-7-5-6-20(16-21)17-27-14-12-19(13-15-27)18-28-24-10-3-1-8-22(24)23-9-2-4-11-25(23)28/h1-16H,17-18H2/q+1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.13E+4n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 mi...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50464019
PNG
(CHEMBL4245106)
Show SMILES [Cl-].Cc1ccc(C[n+]2cccc(Cn3c4ccccc4c4ccccc34)c2)cc1
Show InChI InChI=1S/C26H23N2/c1-20-12-14-21(15-13-20)17-27-16-6-7-22(18-27)19-28-25-10-4-2-8-23(25)24-9-3-5-11-26(24)28/h2-16,18H,17,19H2,1H3/q+1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.31E+4n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 mi...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50464031
PNG
(CHEMBL4248896)
Show SMILES [Br-].Fc1ccc(C[n+]2cccc(Cn3c4ccccc4c4ccccc34)c2)cc1
Show InChI InChI=1S/C25H20FN2/c26-21-13-11-19(12-14-21)16-27-15-5-6-20(17-27)18-28-24-9-3-1-7-22(24)23-8-2-4-10-25(23)28/h1-15,17H,16,18H2/q+1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.94E+4n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 mi...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50464025
PNG
(CHEMBL4244170)
Show SMILES [Br-].Clc1cccc(C[n+]2cccc(Cn3c4ccccc4c4ccccc34)c2)c1
Show InChI InChI=1S/C25H20ClN2/c26-21-9-5-7-19(15-21)16-27-14-6-8-20(17-27)18-28-24-12-3-1-10-22(24)23-11-2-4-13-25(23)28/h1-15,17H,16,18H2/q+1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.28E+4n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 mi...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50464021
PNG
(CHEMBL4241338)
Show SMILES [Br-].Cc1ccccc1C[n+]1cccc(Cn2c3ccccc3c3ccccc23)c1
Show InChI InChI=1S/C26H23N2/c1-20-9-2-3-11-22(20)19-27-16-8-10-21(17-27)18-28-25-14-6-4-12-23(25)24-13-5-7-15-26(24)28/h2-17H,18-19H2,1H3/q+1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5.25E+4n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 mi...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50464029
PNG
(CHEMBL4242583)
Show SMILES [Br-].C(c1ccc[n+](Cc2ccccc2)c1)n1c2ccccc2c2ccccc12
Show InChI InChI=1S/C25H21N2/c1-2-9-20(10-3-1)17-26-16-8-11-21(18-26)19-27-24-14-6-4-12-22(24)23-13-5-7-15-25(23)27/h1-16,18H,17,19H2/q+1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6.19E+4n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 mi...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50464030
PNG
(CHEMBL4244620)
Show SMILES [Cl-].Cc1cccc(C[n+]2cccc(Cn3c4ccccc4c4ccccc34)c2)c1
Show InChI InChI=1S/C26H23N2/c1-20-8-6-9-21(16-20)17-27-15-7-10-22(18-27)19-28-25-13-4-2-11-23(25)24-12-3-5-14-26(24)28/h2-16,18H,17,19H2,1H3/q+1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6.60E+4n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 mi...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50464022
PNG
(CHEMBL4244767)
Show SMILES [Cl-].Clc1ccccc1C[n+]1cccc(Cn2c3ccccc3c3ccccc23)c1
Show InChI InChI=1S/C25H20ClN2/c26-23-12-4-1-9-20(23)18-27-15-7-8-19(16-27)17-28-24-13-5-2-10-21(24)22-11-3-6-14-25(22)28/h1-16H,17-18H2/q+1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 mi...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50464017
PNG
(CHEMBL4247756)
Show SMILES [Cl-].Fc1ccccc1C[n+]1cccc(Cn2c3ccccc3c3ccccc23)c1
Show InChI InChI=1S/C25H20FN2/c26-23-12-4-1-9-20(23)18-27-15-7-8-19(16-27)17-28-24-13-5-2-10-21(24)22-11-3-6-14-25(22)28/h1-16H,17-18H2/q+1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 mi...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50464036
PNG
(CHEMBL4240265)
Show SMILES [Br-].Fc1cccc(C[n+]2cccc(Cn3c4ccccc4c4ccccc34)c2)c1
Show InChI InChI=1S/C25H20FN2/c26-21-9-5-7-19(15-21)16-27-14-6-8-20(17-27)18-28-24-12-3-1-10-22(24)23-11-2-4-13-25(23)28/h1-15,17H,16,18H2/q+1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Tehran University of Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured for 5 mi...


Bioorg Med Chem 26: 4952-4962 (2018)


Article DOI: 10.1016/j.bmc.2018.08.035
BindingDB Entry DOI: 10.7270/Q2NS0XJS
More data for this
Ligand-Target Pair