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PubMed code 23891231

Compile data set for download or QSAR
Found 42 hits of Enzyme Inhibition Constant Data   
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))		BDBM8961
PNG
(1,2,3,4-tetrahydro-9-acridinamine | 1,2,3,4-tetrah...)
Show SMILES Nc1c2CCCCc2nc2ccccc12
Show InChI InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15)
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n/an/a 9.80n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of horse serum BChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Acetylcholinesterase


(Electrophorus electricus (Electric eel))		BDBM8961
PNG
(1,2,3,4-tetrahydro-9-acridinamine | 1,2,3,4-tetrah...)
Show SMILES Nc1c2CCCCc2nc2ccccc12
Show InChI InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15)
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n/an/a 75n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))		BDBM50438825
PNG
(CHEMBL2413741)
Show SMILES CC(C)N(CCOc1ccc(cc1)-c1nc2ccc(Cl)cc2[nH]1)C(C)C
Show InChI InChI=1S/C21H26ClN3O/c1-14(2)25(15(3)4)11-12-26-18-8-5-16(6-9-18)21-23-19-10-7-17(22)13-20(19)24-21/h5-10,13-15H,11-12H2,1-4H3,(H,23,24)
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n/an/a 580n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))		BDBM50438843
PNG
(CHEMBL2413743)
Show SMILES Clc1ccc2nc([nH]c2c1)-c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C20H22ClN3O/c21-16-6-9-18-19(14-16)23-20(22-18)15-4-7-17(8-5-15)25-13-12-24-10-2-1-3-11-24/h4-9,14H,1-3,10-13H2,(H,22,23)
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n/an/a 610n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))		BDBM50438830
PNG
(CHEMBL2413736)
Show SMILES Cc1ccc2nc([nH]c2c1)-c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C21H25N3O/c1-16-5-10-19-20(15-16)23-21(22-19)17-6-8-18(9-7-17)25-14-13-24-11-3-2-4-12-24/h5-10,15H,2-4,11-14H2,1H3,(H,22,23)
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n/an/a 840n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))		BDBM50438836
PNG
(CHEMBL2413560)
Show SMILES C(CN1CCCCC1)Oc1ccc(cc1)-c1nc2ccccc2[nH]1
Show InChI InChI=1S/C20H23N3O/c1-4-12-23(13-5-1)14-15-24-17-10-8-16(9-11-17)20-21-18-6-2-3-7-19(18)22-20/h2-3,6-11H,1,4-5,12-15H2,(H,21,22)
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n/an/a 1.08E+3n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))		BDBM50438838
PNG
(CHEMBL2413558)
Show SMILES CC(C)N(CCOc1ccc(cc1)-c1nc2ccccc2[nH]1)C(C)C
Show InChI InChI=1S/C21H27N3O/c1-15(2)24(16(3)4)13-14-25-18-11-9-17(10-12-18)21-22-19-7-5-6-8-20(19)23-21/h5-12,15-16H,13-14H2,1-4H3,(H,22,23)
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n/an/a 1.19E+3n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))		BDBM50438831
PNG
(CHEMBL2413735)
Show SMILES Cc1ccc2nc([nH]c2c1)-c1ccc(OCCN2CCCC2)cc1
Show InChI InChI=1S/C20H23N3O/c1-15-4-9-18-19(14-15)22-20(21-18)16-5-7-17(8-6-16)24-13-12-23-10-2-3-11-23/h4-9,14H,2-3,10-13H2,1H3,(H,21,22)
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n/an/a 1.34E+3n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))		BDBM50438830
PNG
(CHEMBL2413736)
Show SMILES Cc1ccc2nc([nH]c2c1)-c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C21H25N3O/c1-16-5-10-19-20(15-16)23-21(22-19)17-6-8-18(9-7-17)25-14-13-24-11-3-2-4-12-24/h5-10,15H,2-4,11-14H2,1H3,(H,22,23)
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n/an/a 1.37E+3n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of horse serum BChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))		BDBM50438832
PNG
(CHEMBL2413734)
Show SMILES CCN(CC)CCOc1ccc(cc1)-c1nc2ccc(C)cc2[nH]1
Show InChI InChI=1S/C20H25N3O/c1-4-23(5-2)12-13-24-17-9-7-16(8-10-17)20-21-18-11-6-15(3)14-19(18)22-20/h6-11,14H,4-5,12-13H2,1-3H3,(H,21,22)
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n/an/a 2.34E+3n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))		BDBM50438836
PNG
(CHEMBL2413560)
Show SMILES C(CN1CCCCC1)Oc1ccc(cc1)-c1nc2ccccc2[nH]1
Show InChI InChI=1S/C20H23N3O/c1-4-12-23(13-5-1)14-15-24-17-10-8-16(9-11-17)20-21-18-6-2-3-7-19(18)22-20/h2-3,6-11H,1,4-5,12-15H2,(H,21,22)
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n/an/a 2.45E+3n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of horse serum BChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))		BDBM50438827
PNG
(CHEMBL2413739)
Show SMILES CN(C)CCOc1ccc(cc1)-c1nc2ccc(Cl)cc2[nH]1
Show InChI InChI=1S/C17H18ClN3O/c1-21(2)9-10-22-14-6-3-12(4-7-14)17-19-15-8-5-13(18)11-16(15)20-17/h3-8,11H,9-10H2,1-2H3,(H,19,20)
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n/an/a 2.68E+3n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))		BDBM50438837
PNG
(CHEMBL2413559)
Show SMILES C(CN1CCCC1)Oc1ccc(cc1)-c1nc2ccccc2[nH]1
Show InChI InChI=1S/C19H21N3O/c1-2-6-18-17(5-1)20-19(21-18)15-7-9-16(10-8-15)23-14-13-22-11-3-4-12-22/h1-2,5-10H,3-4,11-14H2,(H,20,21)
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n/an/a 3.05E+3n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))		BDBM50438844
PNG
(CHEMBL2413742)
Show SMILES Clc1ccc2nc([nH]c2c1)-c1ccc(OCCN2CCCC2)cc1
Show InChI InChI=1S/C19H20ClN3O/c20-15-5-8-17-18(13-15)22-19(21-17)14-3-6-16(7-4-14)24-12-11-23-9-1-2-10-23/h3-8,13H,1-2,9-12H2,(H,21,22)
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n/an/a 3.24E+3n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))		BDBM50438831
PNG
(CHEMBL2413735)
Show SMILES Cc1ccc2nc([nH]c2c1)-c1ccc(OCCN2CCCC2)cc1
Show InChI InChI=1S/C20H23N3O/c1-15-4-9-18-19(14-15)22-20(21-18)16-5-7-17(8-6-16)24-13-12-23-10-2-3-11-23/h4-9,14H,2-3,10-13H2,1H3,(H,21,22)
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n/an/a 3.24E+3n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of horse serum BChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))		BDBM50438844
PNG
(CHEMBL2413742)
Show SMILES Clc1ccc2nc([nH]c2c1)-c1ccc(OCCN2CCCC2)cc1
Show InChI InChI=1S/C19H20ClN3O/c20-15-5-8-17-18(13-15)22-19(21-17)14-3-6-16(7-4-14)24-12-11-23-9-1-2-10-23/h3-8,13H,1-2,9-12H2,(H,21,22)
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n/an/a 3.42E+3n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of horse serum BChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))		BDBM50438826
PNG
(CHEMBL2413740)
Show SMILES CCN(CC)CCOc1ccc(cc1)-c1nc2ccc(Cl)cc2[nH]1
Show InChI InChI=1S/C19H22ClN3O/c1-3-23(4-2)11-12-24-16-8-5-14(6-9-16)19-21-17-10-7-15(20)13-18(17)22-19/h5-10,13H,3-4,11-12H2,1-2H3,(H,21,22)
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n/an/a 3.50E+3n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))		BDBM50438838
PNG
(CHEMBL2413558)
Show SMILES CC(C)N(CCOc1ccc(cc1)-c1nc2ccccc2[nH]1)C(C)C
Show InChI InChI=1S/C21H27N3O/c1-15(2)24(16(3)4)13-14-25-18-11-9-17(10-12-18)21-22-19-7-5-6-8-20(19)23-21/h5-12,15-16H,13-14H2,1-4H3,(H,22,23)
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n/an/a 4.11E+3n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of horse serum BChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))		BDBM50438841
PNG
(CHEMBL377740)
Show SMILES Oc1ccc(cc1)-c1nc2ccccc2[nH]1
Show InChI InChI=1S/C13H10N2O/c16-10-7-5-9(6-8-10)13-14-11-3-1-2-4-12(11)15-13/h1-8,16H,(H,14,15)
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n/an/a 4.59E+3n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of horse serum BChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))		BDBM50438834
PNG
(CHEMBL2413732)
Show SMILES Cc1ccc2nc([nH]c2c1)-c1ccc(O)cc1
Show InChI InChI=1S/C14H12N2O/c1-9-2-7-12-13(8-9)16-14(15-12)10-3-5-11(17)6-4-10/h2-8,17H,1H3,(H,15,16)
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n/an/a 4.67E+3n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of horse serum BChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))		BDBM50438839
PNG
(CHEMBL2413745)
Show SMILES CCN(CC)CCOc1ccc(cc1)-c1nc2ccccc2[nH]1
Show InChI InChI=1S/C19H23N3O/c1-3-22(4-2)13-14-23-16-11-9-15(10-12-16)19-20-17-7-5-6-8-18(17)21-19/h5-12H,3-4,13-14H2,1-2H3,(H,20,21)
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n/an/a 5.06E+3n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of horse serum BChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))		BDBM50438833
PNG
(CHEMBL2413733)
Show SMILES CN(C)CCOc1ccc(cc1)-c1nc2ccc(C)cc2[nH]1
Show InChI InChI=1S/C18H21N3O/c1-13-4-9-16-17(12-13)20-18(19-16)14-5-7-15(8-6-14)22-11-10-21(2)3/h4-9,12H,10-11H2,1-3H3,(H,19,20)
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n/an/a 5.06E+3n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))		BDBM50438840
PNG
(CHEMBL2413746)
Show SMILES CN(C)CCOc1ccc(cc1)-c1nc2ccccc2[nH]1
Show InChI InChI=1S/C17H19N3O/c1-20(2)11-12-21-14-9-7-13(8-10-14)17-18-15-5-3-4-6-16(15)19-17/h3-10H,11-12H2,1-2H3,(H,18,19)
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n/an/a 5.87E+3n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of horse serum BChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))		BDBM50438832
PNG
(CHEMBL2413734)
Show SMILES CCN(CC)CCOc1ccc(cc1)-c1nc2ccc(C)cc2[nH]1
Show InChI InChI=1S/C20H25N3O/c1-4-23(5-2)12-13-24-17-9-7-16(8-10-17)20-21-18-11-6-15(3)14-19(18)22-20/h6-11,14H,4-5,12-13H2,1-3H3,(H,21,22)
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n/an/a 6.48E+3n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of horse serum BChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))		BDBM50438825
PNG
(CHEMBL2413741)
Show SMILES CC(C)N(CCOc1ccc(cc1)-c1nc2ccc(Cl)cc2[nH]1)C(C)C
Show InChI InChI=1S/C21H26ClN3O/c1-14(2)25(15(3)4)11-12-26-18-8-5-16(6-9-18)21-23-19-10-7-17(22)13-20(19)24-21/h5-10,13-15H,11-12H2,1-4H3,(H,23,24)
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n/an/a 7.44E+3n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of horse serum BChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))		BDBM50438828
PNG
(CHEMBL2413738)
Show SMILES Oc1ccc(cc1)-c1nc2ccc(Cl)cc2[nH]1
Show InChI InChI=1S/C13H9ClN2O/c14-9-3-6-11-12(7-9)16-13(15-11)8-1-4-10(17)5-2-8/h1-7,17H,(H,15,16)
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n/an/a 8.52E+3n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of horse serum BChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))		BDBM50438842
PNG
(CHEMBL2413744)
Show SMILES Clc1ccc2nc([nH]c2c1)-c1ccc(OCCN2CCOCC2)cc1
Show InChI InChI=1S/C19H20ClN3O2/c20-15-3-6-17-18(13-15)22-19(21-17)14-1-4-16(5-2-14)25-12-9-23-7-10-24-11-8-23/h1-6,13H,7-12H2,(H,21,22)
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n/an/a 1.11E+4n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))		BDBM50438840
PNG
(CHEMBL2413746)
Show SMILES CN(C)CCOc1ccc(cc1)-c1nc2ccccc2[nH]1
Show InChI InChI=1S/C17H19N3O/c1-20(2)11-12-21-14-9-7-13(8-10-14)17-18-15-5-3-4-6-16(15)19-17/h3-10H,11-12H2,1-2H3,(H,18,19)
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n/an/a 1.31E+4n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))		BDBM50438828
PNG
(CHEMBL2413738)
Show SMILES Oc1ccc(cc1)-c1nc2ccc(Cl)cc2[nH]1
Show InChI InChI=1S/C13H9ClN2O/c14-9-3-6-11-12(7-9)16-13(15-11)8-1-4-10(17)5-2-8/h1-7,17H,(H,15,16)
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n/an/a 1.46E+4n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))		BDBM50438839
PNG
(CHEMBL2413745)
Show SMILES CCN(CC)CCOc1ccc(cc1)-c1nc2ccccc2[nH]1
Show InChI InChI=1S/C19H23N3O/c1-3-22(4-2)13-14-23-16-11-9-15(10-12-16)19-20-17-7-5-6-8-18(17)21-19/h5-12H,3-4,13-14H2,1-2H3,(H,20,21)
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n/an/a 1.56E+4n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))		BDBM50438834
PNG
(CHEMBL2413732)
Show SMILES Cc1ccc2nc([nH]c2c1)-c1ccc(O)cc1
Show InChI InChI=1S/C14H12N2O/c1-9-2-7-12-13(8-9)16-14(15-12)10-3-5-11(17)6-4-10/h2-8,17H,1H3,(H,15,16)
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n/an/a 1.59E+4n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))		BDBM50438841
PNG
(CHEMBL377740)
Show SMILES Oc1ccc(cc1)-c1nc2ccccc2[nH]1
Show InChI InChI=1S/C13H10N2O/c16-10-7-5-9(6-8-10)13-14-11-3-1-2-4-12(11)15-13/h1-8,16H,(H,14,15)
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n/an/a 1.73E+4n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))		BDBM50438835
PNG
(CHEMBL2413561)
Show SMILES C(CN1CCOCC1)Oc1ccc(cc1)-c1nc2ccccc2[nH]1
Show InChI InChI=1S/C19H21N3O2/c1-2-4-18-17(3-1)20-19(21-18)15-5-7-16(8-6-15)24-14-11-22-9-12-23-13-10-22/h1-8H,9-14H2,(H,20,21)
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n/an/a 1.88E+4n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))		BDBM50438837
PNG
(CHEMBL2413559)
Show SMILES C(CN1CCCC1)Oc1ccc(cc1)-c1nc2ccccc2[nH]1
Show InChI InChI=1S/C19H21N3O/c1-2-6-18-17(5-1)20-19(21-18)15-7-9-16(10-8-15)23-14-13-22-11-3-4-12-22/h1-2,5-10H,3-4,11-14H2,(H,20,21)
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n/an/a 2.31E+4n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of horse serum BChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))		BDBM50438842
PNG
(CHEMBL2413744)
Show SMILES Clc1ccc2nc([nH]c2c1)-c1ccc(OCCN2CCOCC2)cc1
Show InChI InChI=1S/C19H20ClN3O2/c20-15-3-6-17-18(13-15)22-19(21-17)14-1-4-16(5-2-14)25-12-9-23-7-10-24-11-8-23/h1-6,13H,7-12H2,(H,21,22)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of horse serum BChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))		BDBM50438829
PNG
(CHEMBL2413737)
Show SMILES Cc1ccc2nc([nH]c2c1)-c1ccc(OCCN2CCOCC2)cc1
Show InChI InChI=1S/C20H23N3O2/c1-15-2-7-18-19(14-15)22-20(21-18)16-3-5-17(6-4-16)25-13-10-23-8-11-24-12-9-23/h2-7,14H,8-13H2,1H3,(H,21,22)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of horse serum BChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))		BDBM50438833
PNG
(CHEMBL2413733)
Show SMILES CN(C)CCOc1ccc(cc1)-c1nc2ccc(C)cc2[nH]1
Show InChI InChI=1S/C18H21N3O/c1-13-4-9-16-17(12-13)20-18(19-16)14-5-7-15(8-6-14)22-11-10-21(2)3/h4-9,12H,10-11H2,1-3H3,(H,19,20)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of horse serum BChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))		BDBM50438835
PNG
(CHEMBL2413561)
Show SMILES C(CN1CCOCC1)Oc1ccc(cc1)-c1nc2ccccc2[nH]1
Show InChI InChI=1S/C19H21N3O2/c1-2-4-18-17(3-1)20-19(21-18)15-5-7-16(8-6-15)24-14-11-22-9-12-23-13-10-22/h1-8H,9-14H2,(H,20,21)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of horse serum BChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))		BDBM50438826
PNG
(CHEMBL2413740)
Show SMILES CCN(CC)CCOc1ccc(cc1)-c1nc2ccc(Cl)cc2[nH]1
Show InChI InChI=1S/C19H22ClN3O/c1-3-23(4-2)11-12-24-16-8-5-14(6-9-16)19-21-17-10-7-15(20)13-18(17)22-19/h5-10,13H,3-4,11-12H2,1-2H3,(H,21,22)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of horse serum BChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))		BDBM50438829
PNG
(CHEMBL2413737)
Show SMILES Cc1ccc2nc([nH]c2c1)-c1ccc(OCCN2CCOCC2)cc1
Show InChI InChI=1S/C20H23N3O2/c1-15-2-7-18-19(14-15)22-20(21-18)16-3-5-17(6-4-16)25-13-10-23-8-11-24-12-9-23/h2-7,14H,8-13H2,1H3,(H,21,22)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))		BDBM50438843
PNG
(CHEMBL2413743)
Show SMILES Clc1ccc2nc([nH]c2c1)-c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C20H22ClN3O/c21-16-6-9-18-19(14-16)23-20(22-18)15-4-7-17(8-5-15)25-13-12-24-10-2-1-3-11-24/h4-9,14H,1-3,10-13H2,(H,22,23)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of horse serum BChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))		BDBM50438827
PNG
(CHEMBL2413739)
Show SMILES CN(C)CCOc1ccc(cc1)-c1nc2ccc(Cl)cc2[nH]1
Show InChI InChI=1S/C17H18ClN3O/c1-21(2)9-10-22-14-6-3-12(4-7-14)17-19-15-8-5-13(18)11-16(15)20-17/h3-8,11H,9-10H2,1-2H3,(H,19,20)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Ege University

Curated by ChEMBL


Assay Description
Inhibition of horse serum BChE using acetylthiocholine iodide as substrate preincubated for 5 mins before substrate addition by Ellman's method

Bioorg Med Chem 21: 4928-37 (2013)


Article DOI: 10.1016/j.bmc.2013.06.065
BindingDB Entry DOI: 10.7270/Q21837XT
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%