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Compile Data Set for Download or QSAR

Found 104 hits with Last Name = 'ning' and Initial = 'fx'   
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
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50293451
PNG
(1-Methyl-1-[2-(7-oxo-7H-1-aza-benzo[de]anthracen-9...)
Show SMILES C[N+]1(CCC(=O)Nc2ccc-3c(c2)C(=O)c2cccc4ccnc-3c24)CCCCC1
Show InChI InChI=1S/C25H25N3O2/c1-28(13-3-2-4-14-28)15-11-22(29)27-18-8-9-19-21(16-18)25(30)20-7-5-6-17-10-12-26-24(19)23(17)20/h5-10,12,16H,2-4,11,13-15H2,1H3/p+1
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0.310n/an/an/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by LB plot


Eur J Med Chem 44: 2523-32 (2009)


Article DOI: 10.1016/j.ejmech.2009.01.021
BindingDB Entry DOI: 10.7270/Q2Z89CFV
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50293452
PNG
(1-methyl-1-(3-(7-oxo-7H-dibenzo[de,g]quinoline-4-c...)
Show SMILES C[N+]1(CCCNC(=O)c2cnc3C(=O)c4ccccc4-c4cccc2c34)CCCCC1
Show InChI InChI=1S/C26H27N3O2/c1-29(14-5-2-6-15-29)16-8-13-27-26(31)22-17-28-24-23-19(11-7-12-20(22)23)18-9-3-4-10-21(18)25(24)30/h3-4,7,9-12,17H,2,5-6,8,13-16H2,1H3/p+1
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110n/an/an/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by LB plot


Eur J Med Chem 44: 2523-32 (2009)


Article DOI: 10.1016/j.ejmech.2009.01.021
BindingDB Entry DOI: 10.7270/Q2Z89CFV
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50211247
PNG
(9-Amino-1-azabenzanthrone | 9-amino-1-aza-benzo[de...)
Show SMILES Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13
Show InChI InChI=1S/C16H10N2O/c17-10-4-5-11-13(8-10)16(19)12-3-1-2-9-6-7-18-15(11)14(9)12/h1-8H,17H2
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3.86E+3n/an/an/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by LB plot


Eur J Med Chem 44: 2523-32 (2009)


Article DOI: 10.1016/j.ejmech.2009.01.021
BindingDB Entry DOI: 10.7270/Q2Z89CFV
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50293443
PNG
(7-Oxo-7H-dibenzo[de,g]quinoline | CHEMBL559502)
Show SMILES O=C1c2ccccc2-c2cccc3ccnc1c23
Show InChI InChI=1S/C16H9NO/c18-16-13-6-2-1-5-11(13)12-7-3-4-10-8-9-17-15(16)14(10)12/h1-9H
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1.46E+4n/an/an/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by LB plot


Eur J Med Chem 44: 2523-32 (2009)


Article DOI: 10.1016/j.ejmech.2009.01.021
BindingDB Entry DOI: 10.7270/Q2Z89CFV
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50293451
PNG
(1-Methyl-1-[2-(7-oxo-7H-1-aza-benzo[de]anthracen-9...)
Show SMILES C[N+]1(CCC(=O)Nc2ccc-3c(c2)C(=O)c2cccc4ccnc-3c24)CCCCC1
Show InChI InChI=1S/C25H25N3O2/c1-28(13-3-2-4-14-28)15-11-22(29)27-18-8-9-19-21(16-18)25(30)20-7-5-6-17-10-12-26-24(19)23(17)20/h5-10,12,16H,2-4,11,13-15H2,1H3/p+1
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n/an/a 0.480n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by Ellman's method


Eur J Med Chem 44: 2523-32 (2009)


Article DOI: 10.1016/j.ejmech.2009.01.021
BindingDB Entry DOI: 10.7270/Q2Z89CFV
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50211239
PNG
(1-methyl-1-[2-(7-oxo-7H-1-aza-benzo[de]anthracen-9...)
Show SMILES C[N+]1(CCC(=O)Nc2ccc-3c(c2)C(=O)c2cccc4ccnc-3c24)CCCC1
Show InChI InChI=1S/C24H23N3O2/c1-27(12-2-3-13-27)14-10-21(28)26-17-7-8-18-20(15-17)24(29)19-6-4-5-16-9-11-25-23(18)22(16)19/h4-9,11,15H,2-3,10,12-14H2,1H3/p+1
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n/an/a 1.06n/an/an/an/an/an/a



Sun Yat-Sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE


Bioorg Med Chem Lett 17: 3765-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50211252
PNG
(1-methyl-1-[(7-oxo-7H-1-aza-benzo[de]anthracen-9-y...)
Show SMILES C[N+]1(CC(=O)Nc2ccc-3c(c2)C(=O)c2cccc4ccnc-3c24)CCCC1
Show InChI InChI=1S/C23H21N3O2/c1-26(11-2-3-12-26)14-20(27)25-16-7-8-17-19(13-16)23(28)18-6-4-5-15-9-10-24-22(17)21(15)18/h4-10,13H,2-3,11-12,14H2,1H3/p+1
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n/an/a 1.08n/an/an/an/an/an/a



Sun Yat-Sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE


Bioorg Med Chem Lett 17: 3765-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50211241
PNG
(9-[3-Pyrrolidinopropionamido]-1-azabenzanthrone | ...)
Show SMILES O=C(CCN1CCCC1)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13
Show InChI InChI=1S/C23H21N3O2/c27-20(9-13-26-11-1-2-12-26)25-16-6-7-17-19(14-16)23(28)18-5-3-4-15-8-10-24-22(17)21(15)18/h3-8,10,14H,1-2,9,11-13H2,(H,25,27)
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n/an/a 2.47n/an/an/an/an/an/a



Sun Yat-Sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE


Bioorg Med Chem Lett 17: 3765-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50211250
PNG
(1-methyl-1-[3-(7-oxo-7H-1-aza-benzo[de]anthracen-9...)
Show SMILES C[N+]1(CCCC(=O)Nc2ccc-3c(c2)C(=O)c2cccc4ccnc-3c24)CCCC1
Show InChI InChI=1S/C25H25N3O2/c1-28(13-2-3-14-28)15-5-8-22(29)27-18-9-10-19-21(16-18)25(30)20-7-4-6-17-11-12-26-24(19)23(17)20/h4,6-7,9-12,16H,2-3,5,8,13-15H2,1H3/p+1
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n/an/a 2.51n/an/an/an/an/an/a



Sun Yat-Sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE


Bioorg Med Chem Lett 17: 3765-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50293446
PNG
(CHEMBL556249 | Diethyl-methyl-[2-(7-oxo-7H-1-aza-b...)
Show SMILES CC[N+](C)(CC)CCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13
Show InChI InChI=1S/C24H25N3O2/c1-4-27(3,5-2)14-12-21(28)26-17-9-10-18-20(15-17)24(29)19-8-6-7-16-11-13-25-23(18)22(16)19/h6-11,13,15H,4-5,12,14H2,1-3H3/p+1
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n/an/a 2.62n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by Ellman's method


Eur J Med Chem 44: 2523-32 (2009)


Article DOI: 10.1016/j.ejmech.2009.01.021
BindingDB Entry DOI: 10.7270/Q2Z89CFV
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50371216
PNG
(CHEMBL554252)
Show SMILES CC[N+](C)(CC)CCCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13
Show InChI InChI=1S/C25H27N3O2/c1-4-28(3,5-2)15-7-10-22(29)27-18-11-12-19-21(16-18)25(30)20-9-6-8-17-13-14-26-24(19)23(17)20/h6,8-9,11-14,16H,4-5,7,10,15H2,1-3H3/p+1
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n/an/a 2.62n/an/an/an/an/an/a



Sun Yat-Sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE


Bioorg Med Chem Lett 17: 3765-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50211253
PNG
(CHEMBL245668 | trimethyl-[3-(7-oxo-7H-1-aza-benzo[...)
Show SMILES C[N+](C)(C)CCCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13
Show InChI InChI=1S/C23H23N3O2/c1-26(2,3)13-5-8-20(27)25-16-9-10-17-19(14-16)23(28)18-7-4-6-15-11-12-24-22(17)21(15)18/h4,6-7,9-12,14H,5,8,13H2,1-3H3/p+1
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n/an/a 4.79n/an/an/an/an/an/a



Sun Yat-Sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE


Bioorg Med Chem Lett 17: 3765-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50211244
PNG
(CHEMBL395926 | Trimethyl-[2-(7-oxo-7H-1-aza-benzo[...)
Show SMILES C[N+](C)(C)CCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13
Show InChI InChI=1S/C22H21N3O2/c1-25(2,3)12-10-19(26)24-15-7-8-16-18(13-15)22(27)17-6-4-5-14-9-11-23-21(16)20(14)17/h4-9,11,13H,10,12H2,1-3H3/p+1
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n/an/a 4.81n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by Ellman's method


Eur J Med Chem 44: 2523-32 (2009)


Article DOI: 10.1016/j.ejmech.2009.01.021
BindingDB Entry DOI: 10.7270/Q2Z89CFV
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50211244
PNG
(CHEMBL395926 | Trimethyl-[2-(7-oxo-7H-1-aza-benzo[...)
Show SMILES C[N+](C)(C)CCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13
Show InChI InChI=1S/C22H21N3O2/c1-25(2,3)12-10-19(26)24-15-7-8-16-18(13-15)22(27)17-6-4-5-14-9-11-23-21(16)20(14)17/h4-9,11,13H,10,12H2,1-3H3/p+1
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n/an/a 4.81n/an/an/an/an/an/a



Sun Yat-Sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE


Bioorg Med Chem Lett 17: 3765-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50211254
PNG
(9-(Pyrrolidinoacetamido)-1-azabenzanthrone | CHEMB...)
Show SMILES O=C(CN1CCCC1)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13
Show InChI InChI=1S/C22H19N3O2/c26-19(13-25-10-1-2-11-25)24-15-6-7-16-18(12-15)22(27)17-5-3-4-14-8-9-23-21(16)20(14)17/h3-9,12H,1-2,10-11,13H2,(H,24,26)
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n/an/a 6.18n/an/an/an/an/an/a



Sun Yat-Sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE


Bioorg Med Chem Lett 17: 3765-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C
More data for this
Ligand-Target Pair
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 11n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of equine serum BChE by Ellman's method


Eur J Med Chem 46: 1572-81 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.005
BindingDB Entry DOI: 10.7270/Q2TM7BFW
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50211251
PNG
(3-diethylamino-N-(7-oxo-7H-1-aza-benzo[de]anthrace...)
Show SMILES CCN(CC)CCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13
Show InChI InChI=1S/C23H23N3O2/c1-3-26(4-2)13-11-20(27)25-16-8-9-17-19(14-16)23(28)18-7-5-6-15-10-12-24-22(17)21(15)18/h5-10,12,14H,3-4,11,13H2,1-2H3,(H,25,27)
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n/an/a 11.6n/an/an/an/an/an/a



Sun Yat-Sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE


Bioorg Med Chem Lett 17: 3765-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50211238
PNG
(9-(4-Pyrrolidinobutyramido)-1-azabenzanthrone | CH...)
Show SMILES O=C(CCCN1CCCC1)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13
Show InChI InChI=1S/C24H23N3O2/c28-21(7-4-14-27-12-1-2-13-27)26-17-8-9-18-20(15-17)24(29)19-6-3-5-16-10-11-25-23(18)22(16)19/h3,5-6,8-11,15H,1-2,4,7,12-14H2,(H,26,28)
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n/an/a 12.1n/an/an/an/an/an/a



Sun Yat-Sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE


Bioorg Med Chem Lett 17: 3765-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50211248
PNG
(CHEMBL428575 | trimethyl-[(7-oxo-7H-1-aza-benzo[de...)
Show SMILES C[N+](C)(C)CC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13
Show InChI InChI=1S/C21H19N3O2/c1-24(2,3)12-18(25)23-14-7-8-15-17(11-14)21(26)16-6-4-5-13-9-10-22-20(15)19(13)16/h4-11H,12H2,1-3H3/p+1
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n/an/a 14.9n/an/an/an/an/an/a



Sun Yat-Sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE


Bioorg Med Chem Lett 17: 3765-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50342765
PNG
(4-(3-(Piperidin-1-yl)propoxy)-7H-dibenzo[de,h]quin...)
Show SMILES O=C1c2ccccc2-c2nccc3c(OCCCN4CCCCC4)ccc1c23
Show InChI InChI=1S/C24H24N2O2/c27-24-18-8-3-2-7-17(18)23-22-19(11-12-25-23)21(10-9-20(22)24)28-16-6-15-26-13-4-1-5-14-26/h2-3,7-12H,1,4-6,13-16H2
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n/an/a 22n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by Ellman's method


Eur J Med Chem 46: 1572-81 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.005
BindingDB Entry DOI: 10.7270/Q2TM7BFW
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50211242
PNG
(4-dimethylamino-N-(7-oxo-7H-1-aza-benzo[de]anthrac...)
Show SMILES CN(C)CCCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13
Show InChI InChI=1S/C22H21N3O2/c1-25(2)12-4-7-19(26)24-15-8-9-16-18(13-15)22(27)17-6-3-5-14-10-11-23-21(16)20(14)17/h3,5-6,8-11,13H,4,7,12H2,1-2H3,(H,24,26)
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n/an/a 30.5n/an/an/an/an/an/a



Sun Yat-Sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE


Bioorg Med Chem Lett 17: 3765-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50211243
PNG
(3-dimethylamino-N-(7-oxo-7H-1-aza-benzo[de]anthrac...)
Show SMILES CN(C)CCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13
Show InChI InChI=1S/C21H19N3O2/c1-24(2)11-9-18(25)23-14-6-7-15-17(12-14)21(26)16-5-3-4-13-8-10-22-20(15)19(13)16/h3-8,10,12H,9,11H2,1-2H3,(H,23,25)
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n/an/a 33.9n/an/an/an/an/an/a



Sun Yat-Sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE


Bioorg Med Chem Lett 17: 3765-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50342763
PNG
(4-(3-(Diethylamino)propoxy)-7H-dibenzo[de,h]quinol...)
Show SMILES CCN(CC)CCCOc1ccc2C(=O)c3ccccc3-c3nccc1c23
Show InChI InChI=1S/C23H24N2O2/c1-3-25(4-2)14-7-15-27-20-11-10-19-21-18(20)12-13-24-22(21)16-8-5-6-9-17(16)23(19)26/h5-6,8-13H,3-4,7,14-15H2,1-2H3
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n/an/a 34.3n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by Ellman's method


Eur J Med Chem 46: 1572-81 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.005
BindingDB Entry DOI: 10.7270/Q2TM7BFW
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50211245
PNG
(3-(2-hydroxy-ethylamino)-N-(7-oxo-7H-1-aza-benzo[d...)
Show SMILES OCCNCCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13
Show InChI InChI=1S/C21H19N3O3/c25-11-10-22-8-7-18(26)24-14-4-5-15-17(12-14)21(27)16-3-1-2-13-6-9-23-20(15)19(13)16/h1-6,9,12,22,25H,7-8,10-11H2,(H,24,26)
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n/an/a 55.1n/an/an/an/an/an/a



Sun Yat-Sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE


Bioorg Med Chem Lett 17: 3765-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50342764
PNG
(4-(2-(Piperidin-1-yl)ethoxy)-7H-dibenzo[de,h]quino...)
Show SMILES O=C1c2ccccc2-c2nccc3c(OCCN4CCCCC4)ccc1c23
Show InChI InChI=1S/C23H22N2O2/c26-23-17-7-3-2-6-16(17)22-21-18(10-11-24-22)20(9-8-19(21)23)27-15-14-25-12-4-1-5-13-25/h2-3,6-11H,1,4-5,12-15H2
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n/an/a 88n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by Ellman's method


Eur J Med Chem 46: 1572-81 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.005
BindingDB Entry DOI: 10.7270/Q2TM7BFW
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50342761
PNG
(1-methyl-1-(2-(7-oxo-7H-dibenzo[de,h]quinolin-3-yl...)
Show SMILES C[N+]1(CCOc2cnc3-c4ccccc4C(=O)c4cccc2c34)CCCCC1
Show InChI InChI=1S/C24H25N2O2/c1-26(12-5-2-6-13-26)14-15-28-21-16-25-23-17-8-3-4-9-18(17)24(27)20-11-7-10-19(21)22(20)23/h3-4,7-11,16H,2,5-6,12-15H2,1H3/q+1
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n/an/a 95n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by Ellman's method


Eur J Med Chem 46: 1572-81 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.005
BindingDB Entry DOI: 10.7270/Q2TM7BFW
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50211246
PNG
(2-dimethylamino-N-(7-oxo-7H-1-aza-benzo[de]anthrac...)
Show SMILES CN(C)CC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13
Show InChI InChI=1S/C20H17N3O2/c1-23(2)11-17(24)22-13-6-7-14-16(10-13)20(25)15-5-3-4-12-8-9-21-19(14)18(12)15/h3-10H,11H2,1-2H3,(H,22,24)
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n/an/a 96.5n/an/an/an/an/an/a



Sun Yat-Sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE


Bioorg Med Chem Lett 17: 3765-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C
More data for this
Ligand-Target Pair
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 105n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by Ellman's method


Eur J Med Chem 46: 1572-81 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.005
BindingDB Entry DOI: 10.7270/Q2TM7BFW
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50293452
PNG
(1-methyl-1-(3-(7-oxo-7H-dibenzo[de,g]quinoline-4-c...)
Show SMILES C[N+]1(CCCNC(=O)c2cnc3C(=O)c4ccccc4-c4cccc2c34)CCCCC1
Show InChI InChI=1S/C26H27N3O2/c1-29(14-5-2-6-15-29)16-8-13-27-26(31)22-17-28-24-23-19(11-7-12-20(22)23)18-9-3-4-10-21(18)25(24)30/h3-4,7,9-12,17H,2,5-6,8,13-16H2,1H3/p+1
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n/an/a 110n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by Ellman's method


Eur J Med Chem 44: 2523-32 (2009)


Article DOI: 10.1016/j.ejmech.2009.01.021
BindingDB Entry DOI: 10.7270/Q2Z89CFV
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50211249
PNG
(3-(2-dimethylamino-ethylamino)-N-(7-oxo-7H-1-aza-b...)
Show SMILES CN(C)CCNCCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13
Show InChI InChI=1S/C23H24N4O2/c1-27(2)13-12-24-10-9-20(28)26-16-6-7-17-19(14-16)23(29)18-5-3-4-15-8-11-25-22(17)21(15)18/h3-8,11,14,24H,9-10,12-13H2,1-2H3,(H,26,28)
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n/an/a 120n/an/an/an/an/an/a



Sun Yat-Sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE


Bioorg Med Chem Lett 17: 3765-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50342760
PNG
(1-methyl-1-(2-(7-oxo-7H-dibenzo[de,h]quinolin-3-yl...)
Show SMILES C[N+]1(CCOc2cnc3-c4ccccc4C(=O)c4cccc2c34)CCCC1
Show InChI InChI=1S/C23H23N2O2/c1-25(11-4-5-12-25)13-14-27-20-15-24-22-16-7-2-3-8-17(16)23(26)19-10-6-9-18(20)21(19)22/h2-3,6-10,15H,4-5,11-14H2,1H3/q+1
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n/an/a 145n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by Ellman's method


Eur J Med Chem 46: 1572-81 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.005
BindingDB Entry DOI: 10.7270/Q2TM7BFW
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50342762
PNG
(4-(2-(Diethylamino)ethoxy)-7H-dibenzo[de,h]quinoli...)
Show SMILES CCN(CC)CCOc1ccc2C(=O)c3ccccc3-c3nccc1c23
Show InChI InChI=1S/C22H22N2O2/c1-3-24(4-2)13-14-26-19-10-9-18-20-17(19)11-12-23-21(20)15-7-5-6-8-16(15)22(18)25/h5-12H,3-4,13-14H2,1-2H3
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n/an/a 201n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by Ellman's method


Eur J Med Chem 46: 1572-81 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.005
BindingDB Entry DOI: 10.7270/Q2TM7BFW
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50342761
PNG
(1-methyl-1-(2-(7-oxo-7H-dibenzo[de,h]quinolin-3-yl...)
Show SMILES C[N+]1(CCOc2cnc3-c4ccccc4C(=O)c4cccc2c34)CCCCC1
Show InChI InChI=1S/C24H25N2O2/c1-26(12-5-2-6-13-26)14-15-28-21-16-25-23-17-8-3-4-9-18(17)24(27)20-11-7-10-19(21)22(20)23/h3-4,7-11,16H,2,5-6,12-15H2,1H3/q+1
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n/an/a 255n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of equine serum BChE by Ellman's method


Eur J Med Chem 46: 1572-81 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.005
BindingDB Entry DOI: 10.7270/Q2TM7BFW
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50342759
PNG
(CHEMBL1770197 | N,N-diethyl-N-methyl-2-(7-oxo-7H-d...)
Show SMILES CC[N+](C)(CC)CCOc1cnc2-c3ccccc3C(=O)c3cccc1c23
Show InChI InChI=1S/C23H25N2O2/c1-4-25(3,5-2)13-14-27-20-15-24-22-16-9-6-7-10-17(16)23(26)19-12-8-11-18(20)21(19)22/h6-12,15H,4-5,13-14H2,1-3H3/q+1
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n/an/a 258n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by Ellman's method


Eur J Med Chem 46: 1572-81 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.005
BindingDB Entry DOI: 10.7270/Q2TM7BFW
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50342760
PNG
(1-methyl-1-(2-(7-oxo-7H-dibenzo[de,h]quinolin-3-yl...)
Show SMILES C[N+]1(CCOc2cnc3-c4ccccc4C(=O)c4cccc2c34)CCCC1
Show InChI InChI=1S/C23H23N2O2/c1-25(11-4-5-12-25)13-14-27-20-15-24-22-16-7-2-3-8-17(16)23(26)19-10-6-9-18(20)21(19)22/h2-3,6-10,15H,4-5,11-14H2,1H3/q+1
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n/an/a 302n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of equine serum BChE by Ellman's method


Eur J Med Chem 46: 1572-81 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.005
BindingDB Entry DOI: 10.7270/Q2TM7BFW
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50293440
PNG
(1-methyl-1-(2-(7-oxo-7H-dibenzo[de,g]quinoline-4-c...)
Show SMILES C[N+]1(CCNC(=O)c2cnc3C(=O)c4ccccc4-c4cccc2c34)CCCCC1
Show InChI InChI=1S/C25H25N3O2/c1-28(13-5-2-6-14-28)15-12-26-25(30)21-16-27-23-22-18(10-7-11-19(21)22)17-8-3-4-9-20(17)24(23)29/h3-4,7-11,16H,2,5-6,12-15H2,1H3/p+1
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n/an/a 350n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by Ellman's method


Eur J Med Chem 44: 2523-32 (2009)


Article DOI: 10.1016/j.ejmech.2009.01.021
BindingDB Entry DOI: 10.7270/Q2Z89CFV
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50342757
PNG
(3-(2-(Piperidin-1-yl)ethoxy)-7H-dibenzo[de,h]quino...)
Show SMILES O=C1c2ccccc2-c2ncc(OCCN3CCCCC3)c3cccc1c23
Show InChI InChI=1S/C23H22N2O2/c26-23-17-8-3-2-7-16(17)22-21-18(9-6-10-19(21)23)20(15-24-22)27-14-13-25-11-4-1-5-12-25/h2-3,6-10,15H,1,4-5,11-14H2
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n/an/a 375n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by Ellman's method


Eur J Med Chem 46: 1572-81 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.005
BindingDB Entry DOI: 10.7270/Q2TM7BFW
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50342768
PNG
(4-(3-(Dimethylamino)propylamino)-7H-dibenzo[de,h]q...)
Show SMILES CN(C)CCCNc1ccc2C(=O)c3ccccc3-c3nccc1c23
Show InChI InChI=1S/C21H21N3O/c1-24(2)13-5-11-22-18-9-8-17-19-16(18)10-12-23-20(19)14-6-3-4-7-15(14)21(17)25/h3-4,6-10,12,22H,5,11,13H2,1-2H3
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n/an/a 398n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by Ellman's method


Eur J Med Chem 46: 1572-81 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.005
BindingDB Entry DOI: 10.7270/Q2TM7BFW
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50342767
PNG
(4-(3-(4-Methylpiperazin-1-yl)propoxy)-7H-dibenzo[d...)
Show SMILES CN1CCN(CCCOc2ccc3C(=O)c4ccccc4-c4nccc2c34)CC1
Show InChI InChI=1S/C24H25N3O2/c1-26-12-14-27(15-13-26)11-4-16-29-21-8-7-20-22-19(21)9-10-25-23(22)17-5-2-3-6-18(17)24(20)28/h2-3,5-10H,4,11-16H2,1H3
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n/an/a 405n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by Ellman's method


Eur J Med Chem 46: 1572-81 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.005
BindingDB Entry DOI: 10.7270/Q2TM7BFW
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50342766
PNG
(4-(2-(4-Methylpiperazin-1-yl)ethoxy)-7H-dibenzo[de...)
Show SMILES CN1CCN(CCOc2ccc3C(=O)c4ccccc4-c4nccc2c34)CC1
Show InChI InChI=1S/C23H23N3O2/c1-25-10-12-26(13-11-25)14-15-28-20-7-6-19-21-18(20)8-9-24-22(21)16-4-2-3-5-17(16)23(19)27/h2-9H,10-15H2,1H3
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n/an/a 432n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by Ellman's method


Eur J Med Chem 46: 1572-81 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.005
BindingDB Entry DOI: 10.7270/Q2TM7BFW
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50342756
PNG
(3-(2-(Pyrrolidin-1-yl)ethoxy)-7H-dibenzo[de,h]quin...)
Show SMILES O=C1c2ccccc2-c2ncc(OCCN3CCCC3)c3cccc1c23
Show InChI InChI=1S/C22H20N2O2/c25-22-16-7-2-1-6-15(16)21-20-17(8-5-9-18(20)22)19(14-23-21)26-13-12-24-10-3-4-11-24/h1-2,5-9,14H,3-4,10-13H2
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n/an/a 471n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by Ellman's method


Eur J Med Chem 46: 1572-81 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.005
BindingDB Entry DOI: 10.7270/Q2TM7BFW
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
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n/an/a 550n/an/an/an/an/an/a



Sun Yat-Sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE


Bioorg Med Chem Lett 17: 3765-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C
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
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n/an/a 550n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by Ellman's method


Eur J Med Chem 44: 2523-32 (2009)


Article DOI: 10.1016/j.ejmech.2009.01.021
BindingDB Entry DOI: 10.7270/Q2Z89CFV
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50293451
PNG
(1-Methyl-1-[2-(7-oxo-7H-1-aza-benzo[de]anthracen-9...)
Show SMILES C[N+]1(CCC(=O)Nc2ccc-3c(c2)C(=O)c2cccc4ccnc-3c24)CCCCC1
Show InChI InChI=1S/C25H25N3O2/c1-28(13-3-2-4-14-28)15-11-22(29)27-18-8-9-19-21(16-18)25(30)20-7-5-6-17-10-12-26-24(19)23(17)20/h5-10,12,16H,2-4,11,13-15H2,1H3/p+1
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n/an/a 600n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE by Ellman's method


Eur J Med Chem 44: 2523-32 (2009)


Article DOI: 10.1016/j.ejmech.2009.01.021
BindingDB Entry DOI: 10.7270/Q2Z89CFV
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50293447
PNG
(CHEMBL549935 | N,N-diethyl-N-methyl-3-(7-oxo-7H-di...)
Show SMILES CC[N+](C)(CC)CCCNC(=O)c1cnc2C(=O)c3ccccc3-c3cccc1c23
Show InChI InChI=1S/C25H27N3O2/c1-4-28(3,5-2)15-9-14-26-25(30)21-16-27-23-22-18(12-8-13-19(21)22)17-10-6-7-11-20(17)24(23)29/h6-8,10-13,16H,4-5,9,14-15H2,1-3H3/p+1
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n/an/a 650n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by Ellman's method


Eur J Med Chem 44: 2523-32 (2009)


Article DOI: 10.1016/j.ejmech.2009.01.021
BindingDB Entry DOI: 10.7270/Q2Z89CFV
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50342755
PNG
(3-(2-(Diethylamino)ethoxy)-7H-dibenzo[de,h]quinoli...)
Show SMILES CCN(CC)CCOc1cnc2-c3ccccc3C(=O)c3cccc1c23
Show InChI InChI=1S/C22H22N2O2/c1-3-24(4-2)12-13-26-19-14-23-21-15-8-5-6-9-16(15)22(25)18-11-7-10-17(19)20(18)21/h5-11,14H,3-4,12-13H2,1-2H3
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n/an/a 700n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by Ellman's method


Eur J Med Chem 46: 1572-81 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.005
BindingDB Entry DOI: 10.7270/Q2TM7BFW
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50342759
PNG
(CHEMBL1770197 | N,N-diethyl-N-methyl-2-(7-oxo-7H-d...)
Show SMILES CC[N+](C)(CC)CCOc1cnc2-c3ccccc3C(=O)c3cccc1c23
Show InChI InChI=1S/C23H25N2O2/c1-4-25(3,5-2)13-14-27-20-15-24-22-16-9-6-7-10-17(16)23(26)19-12-8-11-18(20)21(19)22/h6-12,15H,4-5,13-14H2,1-3H3/q+1
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n/an/a 708n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of equine serum BChE by Ellman's method


Eur J Med Chem 46: 1572-81 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.005
BindingDB Entry DOI: 10.7270/Q2TM7BFW
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50342757
PNG
(3-(2-(Piperidin-1-yl)ethoxy)-7H-dibenzo[de,h]quino...)
Show SMILES O=C1c2ccccc2-c2ncc(OCCN3CCCCC3)c3cccc1c23
Show InChI InChI=1S/C23H22N2O2/c26-23-17-8-3-2-7-16(17)22-21-18(9-6-10-19(21)23)20(15-24-22)27-14-13-25-11-4-1-5-12-25/h2-3,6-10,15H,1,4-5,11-14H2
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n/an/a 723n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of equine serum BChE by Ellman's method


Eur J Med Chem 46: 1572-81 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.005
BindingDB Entry DOI: 10.7270/Q2TM7BFW
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50342756
PNG
(3-(2-(Pyrrolidin-1-yl)ethoxy)-7H-dibenzo[de,h]quin...)
Show SMILES O=C1c2ccccc2-c2ncc(OCCN3CCCC3)c3cccc1c23
Show InChI InChI=1S/C22H20N2O2/c25-22-16-7-2-1-6-15(16)21-20-17(8-5-9-18(20)22)19(14-23-21)26-13-12-24-10-3-4-11-24/h1-2,5-9,14H,3-4,10-13H2
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n/an/a 790n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of equine serum BChE by Ellman's method


Eur J Med Chem 46: 1572-81 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.005
BindingDB Entry DOI: 10.7270/Q2TM7BFW
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50342765
PNG
(4-(3-(Piperidin-1-yl)propoxy)-7H-dibenzo[de,h]quin...)
Show SMILES O=C1c2ccccc2-c2nccc3c(OCCCN4CCCCC4)ccc1c23
Show InChI InChI=1S/C24H24N2O2/c27-24-18-8-3-2-7-17(18)23-22-19(11-12-25-23)21(10-9-20(22)24)28-16-6-15-26-13-4-1-5-14-26/h2-3,7-12H,1,4-6,13-16H2
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n/an/a 905n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of equine serum BChE by Ellman's method


Eur J Med Chem 46: 1572-81 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.005
BindingDB Entry DOI: 10.7270/Q2TM7BFW
More data for this
Ligand-Target Pair
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