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PubMed code 8558505

Compile data set for download or QSAR
Found 77 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
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9410
PNG
(N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-ethyl-4-(phe...)
Show SMILES CCN(CCC1CCN(Cc2ccccc2)CC1)C(=O)c1ccc(cc1)S(=O)(=O)Cc1ccccc1
Show InChI InChI=1S/C30H36N2O3S/c1-2-32(22-19-25-17-20-31(21-18-25)23-26-9-5-3-6-10-26)30(33)28-13-15-29(16-14-28)36(34,35)24-27-11-7-4-8-12-27/h3-16,25H,2,17-24H2,1H3
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n/an/a 0.301n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9411
PNG
(CHEMBL54058 | N-[2-(1-benzylpiperidin-4-yl)ethyl]-...)
Show SMILES O=C(N(CCC1CCN(Cc2ccccc2)CC1)c1ccccc1)c1ccc(cc1)S(=O)(=O)Cc1ccccc1
Show InChI InChI=1S/C34H36N2O3S/c37-34(31-16-18-33(19-17-31)40(38,39)27-30-12-6-2-7-13-30)36(32-14-8-3-9-15-32)25-22-28-20-23-35(24-21-28)26-29-10-4-1-5-11-29/h1-19,28H,20-27H2
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n/an/a 0.600n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9409
PNG
(CHEMBL299708 | N-[2-(1-benzylpiperidin-4-yl)ethyl]...)
Show SMILES CN(CCC1CCN(Cc2ccccc2)CC1)C(=O)c1ccc(cc1)S(=O)(=O)Cc1ccccc1
Show InChI InChI=1S/C29H34N2O3S/c1-30(19-16-24-17-20-31(21-18-24)22-25-8-4-2-5-9-25)29(32)27-12-14-28(15-13-27)35(33,34)23-26-10-6-3-7-11-26/h2-15,24H,16-23H2,1H3
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n/an/a 0.600n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50039721
PNG
(3-(2-(1-benzylpiperidin-4-yl)ethyl)-6-morpholinobe...)
Show SMILES C(Cc1noc2cc(ccc12)N1CCOCC1)C1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C25H31N3O2/c1-2-4-21(5-3-1)19-27-12-10-20(11-13-27)6-9-24-23-8-7-22(18-25(23)30-26-24)28-14-16-29-17-15-28/h1-5,7-8,18,20H,6,9-17,19H2
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n/an/a 0.800n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50032165
PNG
(CHEMBL92736 | CHEMBL94217 | N-{3-[2-(1-Benzyl-pipe...)
Show SMILES CC(=O)Nc1ccc2c(CCC3CCN(Cc4ccccc4)CC3)noc2c1
Show InChI InChI=1S/C23H27N3O2/c1-17(27)24-20-8-9-21-22(25-28-23(21)15-20)10-7-18-11-13-26(14-12-18)16-19-5-3-2-4-6-19/h2-6,8-9,15,18H,7,10-14,16H2,1H3,(H,24,27)
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n/an/a 2.80n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM50003996
PNG
(CHEMBL126354 | N-(2-(1-benzylpiperidin-4-yl)ethyl)...)
Show SMILES [O-][N+](=O)c1ccc(cc1)C(=O)N(CCC1CCN(Cc2ccccc2)CC1)c1ccccc1
Show InChI InChI=1S/C27H29N3O3/c31-27(24-11-13-26(14-12-24)30(32)33)29(25-9-5-2-6-10-25)20-17-22-15-18-28(19-16-22)21-23-7-3-1-4-8-23/h1-14,22H,15-21H2
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n/an/a 5.40n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50039729
PNG
(3-(2-(1-benzylpiperidin-4-yl)ethyl)-5,6-dimethylbe...)
Show SMILES Cc1cc2onc(CCC3CCN(Cc4ccccc4)CC3)c2cc1C
Show InChI InChI=1S/C23H28N2O/c1-17-14-21-22(24-26-23(21)15-18(17)2)9-8-19-10-12-25(13-11-19)16-20-6-4-3-5-7-20/h3-7,14-15,19H,8-13,16H2,1-2H3
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n/an/a 5.79n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50039713
PNG
(3-(2-(1-benzylpiperidin-4-yl)ethyl)-7-methoxybenzo...)
Show SMILES COc1cccc2c(CCC3CCN(Cc4ccccc4)CC3)noc12
Show InChI InChI=1S/C22H26N2O2/c1-25-21-9-5-8-19-20(23-26-22(19)21)11-10-17-12-14-24(15-13-17)16-18-6-3-2-4-7-18/h2-9,17H,10-16H2,1H3
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n/an/a 7.10n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50039712
PNG
(3-(2-(1-benzylpiperidin-4-yl)ethyl)-5-methoxybenzo...)
Show SMILES COc1ccc2onc(CCC3CCN(Cc4ccccc4)CC3)c2c1
Show InChI InChI=1S/C22H26N2O2/c1-25-19-8-10-22-20(15-19)21(23-26-22)9-7-17-11-13-24(14-12-17)16-18-5-3-2-4-6-18/h2-6,8,10,15,17H,7,9,11-14,16H2,1H3
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n/an/a 7.19n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50039728
PNG
(3-(2-(1-benzylpiperidin-4-yl)ethyl)-5-methylbenzo[...)
Show SMILES Cc1ccc2onc(CCC3CCN(Cc4ccccc4)CC3)c2c1
Show InChI InChI=1S/C22H26N2O/c1-17-7-10-22-20(15-17)21(23-25-22)9-8-18-11-13-24(14-12-18)16-19-5-3-2-4-6-19/h2-7,10,15,18H,8-9,11-14,16H2,1H3
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n/an/a 7.80n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM8960
PNG
((+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimet...)
Show SMILES COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC
Show InChI InChI=1/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
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n/an/a 8n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Cholinesterases


(Homo sapiens (Human))
BDBM50039717
PNG
(3-(2-(1-benzylpiperidin-4-yl)ethyl)-6-methoxybenzo...)
Show SMILES COc1ccc2c(CCC3CCN(Cc4ccccc4)CC3)noc2c1
Show InChI InChI=1S/C22H26N2O2/c1-25-19-8-9-20-21(23-26-22(20)15-19)10-7-17-11-13-24(14-12-17)16-18-5-3-2-4-6-18/h2-6,8-9,15,17H,7,10-14,16H2,1H3
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n/an/a 8.30n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50039723
PNG
(3-(2-(1-benzylpiperidin-4-yl)ethyl)benzo[d]isoxazo...)
Show SMILES NC(=O)c1ccc2c(CCC3CCN(Cc4ccccc4)CC3)noc2c1
Show InChI InChI=1S/C22H25N3O2/c23-22(26)18-7-8-19-20(24-27-21(19)14-18)9-6-16-10-12-25(13-11-16)15-17-4-2-1-3-5-17/h1-5,7-8,14,16H,6,9-13,15H2,(H2,23,26)
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n/an/a 8.79n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50039727
PNG
(CHEMBL93123 | N-(3-(2-(1-benzylpiperidin-4-yl)ethy...)
Show SMILES O=C(Nc1ccc2c(CCC3CCN(Cc4ccccc4)CC3)noc2c1)c1ccccc1
Show InChI InChI=1S/C28H29N3O2/c32-28(23-9-5-2-6-10-23)29-24-12-13-25-26(30-33-27(25)19-24)14-11-21-15-17-31(18-16-21)20-22-7-3-1-4-8-22/h1-10,12-13,19,21H,11,14-18,20H2,(H,29,32)
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n/an/a 9.40n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50039725
PNG
(CHEMBL92955 | N-(3-(2-(1-benzylpiperidin-4-yl)ethy...)
Show SMILES O=S(=O)(Nc1ccc2c(CCC3CCN(Cc4ccccc4)CC3)noc2c1)c1ccccc1
Show InChI InChI=1S/C27H29N3O3S/c31-34(32,24-9-5-2-6-10-24)29-23-12-13-25-26(28-33-27(25)19-23)14-11-21-15-17-30(18-16-21)20-22-7-3-1-4-8-22/h1-10,12-13,19,21,29H,11,14-18,20H2
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n/an/a 14n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50004000
PNG
((3aS,8aR)-1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydro...)
Show SMILES CNC(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1
Show InChI InChI=1/C15H21N3O2/c1-15-7-8-17(3)13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2/h5-6,9,13H,7-8H2,1-4H3,(H,16,19)/t13-,15+/s2
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n/an/a 19.0n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50039719
PNG
(3-(2-(1-benzylpiperidin-4-yl)ethyl)benzo[d]isoxazo...)
Show SMILES Nc1ccc2c(CCC3CCN(Cc4ccccc4)CC3)noc2c1
Show InChI InChI=1S/C21H25N3O/c22-18-7-8-19-20(23-25-21(19)14-18)9-6-16-10-12-24(13-11-16)15-17-4-2-1-3-5-17/h1-5,7-8,14,16H,6,9-13,15,22H2
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n/an/a 20n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50039731
PNG
(3-(2-(1-benzylpiperidin-4-yl)ethyl)benzo[d]isoxazo...)
Show SMILES Oc1ccc2c(CCC3CCN(Cc4ccccc4)CC3)noc2c1
Show InChI InChI=1S/C21H24N2O2/c24-18-7-8-19-20(22-25-21(19)14-18)9-6-16-10-12-23(13-11-16)15-17-4-2-1-3-5-17/h1-5,7-8,14,16,24H,6,9-13,15H2
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n/an/a 26n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9397
PNG
(CHEMBL59583 | N-[2-(1-benzylpiperidin-4-yl)ethyl]-...)
Show SMILES O=C(NCCC1CCN(Cc2ccccc2)CC1)c1ccc(cc1)S(=O)(=O)Cc1ccccc1
Show InChI InChI=1S/C28H32N2O3S/c31-28(26-11-13-27(14-12-26)34(32,33)22-25-9-5-2-6-10-25)29-18-15-23-16-19-30(20-17-23)21-24-7-3-1-4-8-24/h1-14,23H,15-22H2,(H,29,31)
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n/an/a 29.0n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM50004020
PNG
(2-(2-(1-benzylpiperidin-4-yl)ethyl)isoindoline-1,3...)
Show SMILES O=C1N(CCC2CCN(Cc3ccccc3)CC2)C(=O)c2ccccc12
Show InChI InChI=1S/C22H24N2O2/c25-21-19-8-4-5-9-20(19)22(26)24(21)15-12-17-10-13-23(14-11-17)16-18-6-2-1-3-7-18/h1-9,17H,10-16H2
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n/an/a 30.0n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9408
PNG
((2E)-but-2-enedioic acid; N-[2-(1-benzylpiperidin-...)
Show SMILES O=C(N(CCC1CCN(Cc2ccccc2)CC1)c1ccccc1)c1ccccc1
Show InChI InChI=1S/C27H30N2O/c30-27(25-12-6-2-7-13-25)29(26-14-8-3-9-15-26)21-18-23-16-19-28(20-17-23)22-24-10-4-1-5-11-24/h1-15,23H,16-22H2
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n/an/a 35.0n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9400
PNG
((2E)-but-2-enedioic acid; N-[2-(1-benzylpiperidin-...)
Show SMILES O=C(NCCC1CCN(Cc2ccccc2)CC1)c1ccncc1
Show InChI InChI=1S/C20H25N3O/c24-20(19-7-11-21-12-8-19)22-13-6-17-9-14-23(15-10-17)16-18-4-2-1-3-5-18/h1-5,7-8,11-12,17H,6,9-10,13-16H2,(H,22,24)
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n/an/a 39.0n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM50004017
PNG
(CHEMBL127527 | N-(2-(1-benzylpiperidin-4-yl)ethyl)...)
Show SMILES COc1cccc(c1)N(CCC1CCN(Cc2ccccc2)CC1)C(C)=O
Show InChI InChI=1S/C23H30N2O2/c1-19(26)25(22-9-6-10-23(17-22)27-2)16-13-20-11-14-24(15-12-20)18-21-7-4-3-5-8-21/h3-10,17,20H,11-16,18H2,1-2H3
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n/an/a 46.0n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50039734
PNG
(3-(2-(1-benzylpiperidin-4-yl)ethyl)-6-bromobenzo[d...)
Show SMILES Brc1ccc2c(CCC3CCN(Cc4ccccc4)CC3)noc2c1
Show InChI InChI=1S/C21H23BrN2O/c22-18-7-8-19-20(23-25-21(19)14-18)9-6-16-10-12-24(13-11-16)15-17-4-2-1-3-5-17/h1-5,7-8,14,16H,6,9-13,15H2
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n/an/a 50n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9396
PNG
(CHEMBL56001 | N-[2-(1-benzylpiperidin-4-yl)ethyl]-...)
Show SMILES CC(=O)c1ccc(cc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C23H28N2O2/c1-18(26)21-7-9-22(10-8-21)23(27)24-14-11-19-12-15-25(16-13-19)17-20-5-3-2-4-6-20/h2-10,19H,11-17H2,1H3,(H,24,27)
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n/an/a 51.0n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM50004027
PNG
(CHEMBL340672 | N-(2-(1-benzylpiperidin-4-yl)ethyl)...)
Show SMILES CC(=O)N(CCC1CCN(Cc2ccccc2)CC1)c1ccccc1
Show InChI InChI=1S/C22H28N2O/c1-19(25)24(22-10-6-3-7-11-22)17-14-20-12-15-23(16-13-20)18-21-8-4-2-5-9-21/h2-11,20H,12-18H2,1H3
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n/an/a 52n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50039716
PNG
(3-(2-(1-benzylpiperidin-4-yl)ethyl)benzo[d]isoxazo...)
Show SMILES C(Cc1noc2ccccc12)C1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C21H24N2O/c1-2-6-18(7-3-1)16-23-14-12-17(13-15-23)10-11-20-19-8-4-5-9-21(19)24-22-20/h1-9,17H,10-16H2
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n/an/a 55.0n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9391
PNG
(N-[2-(1-benzylpiperidin-4-yl)ethyl]-4-nitrobenzami...)
Show SMILES [O-][N+](=O)c1ccc(cc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C21H25N3O3/c25-21(19-6-8-20(9-7-19)24(26)27)22-13-10-17-11-14-23(15-12-17)16-18-4-2-1-3-5-18/h1-9,17H,10-16H2,(H,22,25)
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n/an/a 55.0n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM50004036
PNG
(CHEMBL340621 | N-(2-(1-benzylpiperidin-4-yl)ethyl)...)
Show SMILES O=C(N(CCC1CCN(Cc2ccccc2)CC1)c1ccccc1)c1ccncc1
Show InChI InChI=1S/C26H29N3O/c30-26(24-11-16-27-17-12-24)29(25-9-5-2-6-10-25)20-15-22-13-18-28(19-14-22)21-23-7-3-1-4-8-23/h1-12,16-17,22H,13-15,18-21H2
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n/an/a 64.0n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9399
PNG
(CHEMBL299313 | N-[2-(1-benzylpiperidin-4-yl)ethyl]...)
Show SMILES O=C(NCCC1CCN(Cc2ccccc2)CC1)c1cccnc1
Show InChI InChI=1S/C20H25N3O/c24-20(19-7-4-11-21-15-19)22-12-8-17-9-13-23(14-10-17)16-18-5-2-1-3-6-18/h1-7,11,15,17H,8-10,12-14,16H2,(H,22,24)
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n/an/a 69.0n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9395
PNG
(CHEMBL56706 | N-[2-(1-benzylpiperidin-4-yl)ethyl]-...)
Show SMILES Fc1ccc(cc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C21H25FN2O/c22-20-8-6-19(7-9-20)21(25)23-13-10-17-11-14-24(15-12-17)16-18-4-2-1-3-5-18/h1-9,17H,10-16H2,(H,23,25)
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n/an/a 84.9n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9392
PNG
(CHEMBL54835 | N-[2-(1-benzylpiperidin-4-yl)ethyl]-...)
Show SMILES COc1ccc(cc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C22H28N2O2/c1-26-21-9-7-20(8-10-21)22(25)23-14-11-18-12-15-24(16-13-18)17-19-5-3-2-4-6-19/h2-10,18H,11-17H2,1H3,(H,23,25)
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n/an/a 87.9n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50039715
PNG
(3-[2-(1-Benzyl-piperidin-4-yl)-ethyl]-benzo[d]isot...)
Show SMILES C(Cc1nsc2ccccc12)C1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C21H24N2S/c1-2-6-18(7-3-1)16-23-14-12-17(13-15-23)10-11-20-19-8-4-5-9-21(19)24-22-20/h1-9,17H,10-16H2
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n/an/a 97.7n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM50004022
PNG
(2-(2-(1-benzylpiperidin-4-yl)ethyl)isoindolin-1-on...)
Show SMILES O=C1N(CCC2CCN(Cc3ccccc3)CC2)Cc2ccccc12
Show InChI InChI=1S/C22H26N2O/c25-22-21-9-5-4-8-20(21)17-24(22)15-12-18-10-13-23(14-11-18)16-19-6-2-1-3-7-19/h1-9,18H,10-17H2
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n/an/a 98.0n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50039718
PNG
(3-(2-(1-benzylpiperidin-4-yl)ethyl)benzo[d]isoxazo...)
Show SMILES N#Cc1ccc2c(CCC3CCN(Cc4ccccc4)CC3)noc2c1
Show InChI InChI=1S/C22H23N3O/c23-15-19-6-8-20-21(24-26-22(20)14-19)9-7-17-10-12-25(13-11-17)16-18-4-2-1-3-5-18/h1-6,8,14,17H,7,9-13,16H2
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n/an/a 100n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50039720
PNG
(3-[2-(1-Benzyl-piperidin-4-yl)-ethyl]-1H-indazole ...)
Show SMILES C(Cc1n[nH]c2ccccc12)C1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C21H25N3/c1-2-6-18(7-3-1)16-24-14-12-17(13-15-24)10-11-21-19-8-4-5-9-20(19)22-23-21/h1-9,17H,10-16H2,(H,22,23)
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n/an/a 120n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9393
PNG
(CHEMBL56586 | N-[2-(1-benzylpiperidin-4-yl)ethyl]-...)
Show SMILES O=Cc1ccc(cc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C22H26N2O2/c25-17-20-6-8-21(9-7-20)22(26)23-13-10-18-11-14-24(15-12-18)16-19-4-2-1-3-5-19/h1-9,17-18H,10-16H2,(H,23,26)
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n/an/a 120n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9406
PNG
(CHEMBL57696 | N-[2-(1-benzylpiperidin-4-yl)ethyl]-...)
Show SMILES CCN(CCC1CCN(Cc2ccccc2)CC1)C(=O)c1ccccc1
Show InChI InChI=1S/C23H30N2O/c1-2-25(23(26)22-11-7-4-8-12-22)18-15-20-13-16-24(17-14-20)19-21-9-5-3-6-10-21/h3-12,20H,2,13-19H2,1H3
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n/an/a 130n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9413
PNG
(CHEMBL127750 | N-methyl-N-(2-{1-[(3-methylphenyl)m...)
Show SMILES CN(CCC1CCN(Cc2cccc(C)c2)CC1)C(=O)c1ccccc1
Show InChI InChI=1S/C23H30N2O/c1-19-7-6-8-21(17-19)18-25-15-12-20(13-16-25)11-14-24(2)23(26)22-9-4-3-5-10-22/h3-10,17,20H,11-16,18H2,1-2H3
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n/an/a 145n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM50029938
PNG
(2-(1-Benzyl-piperidin-4-ylmethyl)-indan-1-one; hyd...)
Show SMILES O=C1C(CC2CCN(Cc3ccccc3)CC2)Cc2ccccc12
Show InChI InChI=1/C22H25NO/c24-22-20(15-19-8-4-5-9-21(19)22)14-17-10-12-23(13-11-17)16-18-6-2-1-3-7-18/h1-9,17,20H,10-16H2
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n/an/a 150n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9405
PNG
(CHEMBL56470 | N-[2-(1-Benzyl-piperidin-4-yl)-ethyl...)
Show SMILES CN(CCC1CCN(Cc2ccccc2)CC1)C(=O)c1ccccc1
Show InChI InChI=1S/C22H28N2O/c1-23(22(25)21-10-6-3-7-11-21)15-12-19-13-16-24(17-14-19)18-20-8-4-2-5-9-20/h2-11,19H,12-18H2,1H3
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n/an/a 170n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9388
PNG
(N-[2-(1-benzylpiperidin-4-yl)ethyl]-4-methylbenzam...)
Show SMILES Cc1ccc(cc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C22H28N2O/c1-18-7-9-21(10-8-18)22(25)23-14-11-19-12-15-24(16-13-19)17-20-5-3-2-4-6-20/h2-10,19H,11-17H2,1H3,(H,23,25)
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n/an/a 180n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9394
PNG
(CHEMBL55253 | N-[2-(1-benzylpiperidin-4-yl)ethyl]-...)
Show SMILES Clc1ccc(cc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C21H25ClN2O/c22-20-8-6-19(7-9-20)21(25)23-13-10-17-11-14-24(15-12-17)16-18-4-2-1-3-5-18/h1-9,17H,10-16H2,(H,23,25)
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n/an/a 180n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM50004002
PNG
(CHEMBL340609 | N-(2-(1-benzylpiperidin-4-yl)ethyl)...)
Show SMILES CC(=O)N(CCC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1
Show InChI InChI=1S/C22H27FN2O/c1-18(26)25(22-9-7-21(23)8-10-22)16-13-19-11-14-24(15-12-19)17-20-5-3-2-4-6-20/h2-10,19H,11-17H2,1H3
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n/an/a 205n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50318740
PNG
((E)-3-(2-(1-benzylpiperidin-4-yl)vinyl)benzo[d]iso...)
Show SMILES C(N1CCC(CC1)\C=C\c1noc2ccccc12)c1ccccc1
Show InChI InChI=1S/C21H22N2O/c1-2-6-18(7-3-1)16-23-14-12-17(13-15-23)10-11-20-19-8-4-5-9-21(19)24-22-20/h1-11,17H,12-16H2/b11-10+
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n/an/a 210n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50039733
PNG
(1-(2-(1-benzylpiperidin-4-yl)ethyl)isoquinoline | ...)
Show SMILES C(Cc1nccc2ccccc12)C1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C23H26N2/c1-2-6-20(7-3-1)18-25-16-13-19(14-17-25)10-11-23-22-9-5-4-8-21(22)12-15-24-23/h1-9,12,15,19H,10-11,13-14,16-18H2
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n/an/a 220n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9390
PNG
(CHEMBL55466 | N-[2-(1-benzylpiperidin-4-yl)ethyl]-...)
Show SMILES [O-][N+](=O)c1cccc(c1)C(=O)NCCC1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C21H25N3O3/c25-21(19-7-4-8-20(15-19)24(26)27)22-12-9-17-10-13-23(14-11-17)16-18-5-2-1-3-6-18/h1-8,15,17H,9-14,16H2,(H,22,25)
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n/an/a 230n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM50004041
PNG
(2-(2-(1-(4-chlorobenzyl)piperidin-4-yl)ethyl)-5-ni...)
Show SMILES [O-][N+](=O)c1ccc2C(=O)N(CCC3CCN(Cc4ccc(Cl)cc4)CC3)C(=O)c2c1
Show InChI InChI=1S/C22H22ClN3O4/c23-17-3-1-16(2-4-17)14-24-10-7-15(8-11-24)9-12-25-21(27)19-6-5-18(26(29)30)13-20(19)22(25)28/h1-6,13,15H,7-12,14H2
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n/an/a 240n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
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 270n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM50029930
PNG
(2-(1-Benzyl-piperidin-4-ylmethyl)-5,6-dimethoxy-in...)
Show SMILES COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(O)c2cc1OC
Show InChI InChI=1/C24H31NO3/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/h3-7,14-15,17,20,24,26H,8-13,16H2,1-2H3
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n/an/a 300n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50039711
PNG
(Benzo[d]isoxazol-3-yl-(1-benzyl-piperidin-4-ylmeth...)
Show SMILES C(Nc1noc2ccccc12)C1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C20H23N3O/c1-2-6-17(7-3-1)15-23-12-10-16(11-13-23)14-21-20-18-8-4-5-9-19(18)24-22-20/h1-9,16H,10-15H2,(H,21,22)
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n/an/a 320n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50039732
PNG
(4-(2-(1-benzylpiperidin-4-yl)ethyl)quinazoline | 4...)
Show SMILES C(Cc1ncnc2ccccc12)C1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C22H25N3/c1-2-6-19(7-3-1)16-25-14-12-18(13-15-25)10-11-22-20-8-4-5-9-21(20)23-17-24-22/h1-9,17-18H,10-16H2
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n/an/a 340n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9416
PNG
(CHEMBL126827 | N-methyl-N-(2-{1-[(3-nitrophenyl)me...)
Show SMILES CN(CCC1CCN(Cc2cccc(c2)[N+]([O-])=O)CC1)C(=O)c1ccccc1
Show InChI InChI=1S/C22H27N3O3/c1-23(22(26)20-7-3-2-4-8-20)13-10-18-11-14-24(15-12-18)17-19-6-5-9-21(16-19)25(27)28/h2-9,16,18H,10-15,17H2,1H3
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n/an/a 370n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9423
PNG
(CHEMBL419782 | N-{2-[1-(cyclohexylmethyl)piperidin...)
Show SMILES CN(CCC1CCN(CC2CCCCC2)CC1)C(=O)c1ccccc1
Show InChI InChI=1S/C22H34N2O/c1-23(22(25)21-10-6-3-7-11-21)15-12-19-13-16-24(17-14-19)18-20-8-4-2-5-9-20/h3,6-7,10-11,19-20H,2,4-5,8-9,12-18H2,1H3
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n/an/a 410n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9387
PNG
(N-[2-(1-benzylpiperidin-4-yl)ethyl]-3-methylbenzam...)
Show SMILES Cc1cccc(c1)C(=O)NCCC1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C22H28N2O/c1-18-6-5-9-21(16-18)22(25)23-13-10-19-11-14-24(15-12-19)17-20-7-3-2-4-8-20/h2-9,16,19H,10-15,17H2,1H3,(H,23,25)
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n/an/a 470n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9403
PNG
(1-Benzyl-4-(4-oxo-4-phenylbutyl)piperidine Hydroch...)
Show SMILES O=C(CCCC1CCN(Cc2ccccc2)CC1)c1ccccc1
Show InChI InChI=1S/C22H27NO/c24-22(21-11-5-2-6-12-21)13-7-10-19-14-16-23(17-15-19)18-20-8-3-1-4-9-20/h1-6,8-9,11-12,19H,7,10,13-18H2
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n/an/a 530n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9385
PNG
(1-Benzyl-4-[2-(N-benzoylamino)ethyl]piperidine Hyd...)
Show SMILES O=C(NCCC1CCN(Cc2ccccc2)CC1)c1ccccc1
Show InChI InChI=1S/C21H26N2O/c24-21(20-9-5-2-6-10-20)22-14-11-18-12-15-23(16-13-18)17-19-7-3-1-4-8-19/h1-10,18H,11-17H2,(H,22,24)
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n/an/a 560n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM50004021
PNG
(CHEMBL125578 | N-(2-(1-benzylpiperidin-4-yl)ethyl)...)
Show SMILES CN(CCC1CCN(Cc2ccccc2)CC1)C(C)=O
Show InChI InChI=1S/C17H26N2O/c1-15(20)18(2)11-8-16-9-12-19(13-10-16)14-17-6-4-3-5-7-17/h3-7,16H,8-14H2,1-2H3
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n/an/a 659n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9412
PNG
(CHEMBL126304 | N-methyl-N-(2-{1-[(2-methylphenyl)m...)
Show SMILES CN(CCC1CCN(Cc2ccccc2C)CC1)C(=O)c1ccccc1
Show InChI InChI=1S/C23H30N2O/c1-19-8-6-7-11-22(19)18-25-16-13-20(14-17-25)12-15-24(2)23(26)21-9-4-3-5-10-21/h3-11,20H,12-18H2,1-2H3
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n/an/a 769n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9398
PNG
(CHEMBL56079 | N-[2-(1-benzylpiperidin-4-yl)ethyl]p...)
Show SMILES O=C(NCCC1CCN(Cc2ccccc2)CC1)c1ccccn1
Show InChI InChI=1S/C20H25N3O/c24-20(19-8-4-5-12-21-19)22-13-9-17-10-14-23(15-11-17)16-18-6-2-1-3-7-18/h1-8,12,17H,9-11,13-16H2,(H,22,24)
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n/an/a 800n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9389
PNG
((2E)-but-2-enedioic acid; N-[2-(1-benzylpiperidin-...)
Show SMILES [O-][N+](=O)c1ccccc1C(=O)NCCC1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C21H25N3O3/c25-21(19-8-4-5-9-20(19)24(26)27)22-13-10-17-11-14-23(15-12-17)16-18-6-2-1-3-7-18/h1-9,17H,10-16H2,(H,22,25)
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n/an/a 879n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM50039730
PNG
(3-(3-(1-benzylpiperidin-4-yl)propyl)benzo[d]isoxaz...)
Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Cc1noc2ccccc12
Show InChI InChI=1S/C22H26N2O/c1-2-7-19(8-3-1)17-24-15-13-18(14-16-24)9-6-11-21-20-10-4-5-12-22(20)25-23-21/h1-5,7-8,10,12,18H,6,9,11,13-17H2
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PubMed
n/an/a 900n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9407
PNG
(1-Benzyl-4-[2-(N-benzoyl-N-benzylamino)ethyl]-pipe...)
Show SMILES O=C(N(CCC1CCN(Cc2ccccc2)CC1)Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C28H32N2O/c31-28(27-14-8-3-9-15-27)30(23-26-12-6-2-7-13-26)21-18-24-16-19-29(20-17-24)22-25-10-4-1-5-11-25/h1-15,24H,16-23H2
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n/an/a 940n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9386
PNG
(N-[2-(1-benzylpiperidin-4-yl)ethyl]-2-methylbenzam...)
Show SMILES Cc1ccccc1C(=O)NCCC1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C22H28N2O/c1-18-7-5-6-10-21(18)22(25)23-14-11-19-12-15-24(16-13-19)17-20-8-3-2-4-9-20/h2-10,19H,11-17H2,1H3,(H,23,25)
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n/an/a 1.00E+3n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9402
PNG
((2E)-but-2-enedioic acid; N-[2-(1-benzylpiperidin-...)
Show SMILES O=C(NCCC1CCN(Cc2ccccc2)CC1)C1CCCCC1
Show InChI InChI=1S/C21H32N2O/c24-21(20-9-5-2-6-10-20)22-14-11-18-12-15-23(16-13-18)17-19-7-3-1-4-8-19/h1,3-4,7-8,18,20H,2,5-6,9-17H2,(H,22,24)
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n/an/a 1.60E+3n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50039722
PNG
(3-(1-Benzyl-piperidin-4-ylmethoxy)-benzo[d]isoxazo...)
Show SMILES C(Oc1noc2ccccc12)C1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C20H22N2O2/c1-2-6-16(7-3-1)14-22-12-10-17(11-13-22)15-23-20-18-8-4-5-9-19(18)24-21-20/h1-9,17H,10-15H2
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n/an/a 2.58E+3n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM50004010
PNG
(2-((1-benzylpiperidin-4-yl)methyl)-5-nitroisoindol...)
Show SMILES [O-][N+](=O)c1ccc2C(=O)N(CC3CCN(Cc4ccccc4)CC3)C(=O)c2c1
Show InChI InChI=1S/C21H21N3O4/c25-20-18-7-6-17(24(27)28)12-19(18)21(26)23(20)14-16-8-10-22(11-9-16)13-15-4-2-1-3-5-15/h1-7,12,16H,8-11,13-14H2
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n/an/a 3.00E+3n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9417
PNG
(CHEMBL125571 | N-methyl-N-(2-{1-[(4-nitrophenyl)me...)
Show SMILES CN(CCC1CCN(Cc2ccc(cc2)[N+]([O-])=O)CC1)C(=O)c1ccccc1
Show InChI InChI=1S/C22H27N3O3/c1-23(22(26)20-5-3-2-4-6-20)14-11-18-12-15-24(16-13-18)17-19-7-9-21(10-8-19)25(27)28/h2-10,18H,11-17H2,1H3
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n/an/a 3.30E+3n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM50029949
PNG
(5,6-Dimethoxy-2-piperidin-4-ylmethyl-indan-1-one; ...)
Show SMILES COc1cc2CC(CC3CCNCC3)C(=O)c2cc1OC
Show InChI InChI=1/C17H23NO3/c1-20-15-9-12-8-13(7-11-3-5-18-6-4-11)17(19)14(12)10-16(15)21-2/h9-11,13,18H,3-8H2,1-2H3
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n/an/a 5.40E+3n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM50407941
PNG
(CHEMBL338596)
Show SMILES O=C(NCCC1CCN(CCc2ccccc2)CC1)c1ccccc1
Show InChI InChI=1S/C22H28N2O/c25-22(21-9-5-2-6-10-21)23-15-11-20-13-17-24(18-14-20)16-12-19-7-3-1-4-8-19/h1-10,20H,11-18H2,(H,23,25)
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n/an/a 1.30E+4n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9415
PNG
(CHEMBL340382 | N-methyl-N-(2-{1-[(2-nitrophenyl)me...)
Show SMILES CN(CCC1CCN(Cc2ccccc2[N+]([O-])=O)CC1)C(=O)c1ccccc1
Show InChI InChI=1S/C22H27N3O3/c1-23(22(26)19-7-3-2-4-8-19)14-11-18-12-15-24(16-13-18)17-20-9-5-6-10-21(20)25(27)28/h2-10,18H,11-17H2,1H3
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n/an/a 1.40E+4n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM50407951
PNG
(CHEMBL339484)
Show SMILES CN(CCC1CCN(CC23CC4CC(CC(C4)C2)C3)CC1)C(=O)c1ccccc1
Show InChI InChI=1S/C26H38N2O/c1-27(25(29)24-5-3-2-4-6-24)10-7-20-8-11-28(12-9-20)19-26-16-21-13-22(17-26)15-23(14-21)18-26/h2-6,20-23H,7-19H2,1H3
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n/an/a 2.40E+4n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM50407936
PNG
(CHEMBL127917)
Show SMILES O=C(NCCC1CCNCC1)c1ccccc1
Show InChI InChI=1S/C14H20N2O/c17-14(13-4-2-1-3-5-13)16-11-8-12-6-9-15-10-7-12/h1-5,12,15H,6-11H2,(H,16,17)
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n/an/a 2.60E+4n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9422
PNG
(CHEMBL126457 | N-{2-[1-(cyclopropylmethyl)piperidi...)
Show SMILES CN(CCC1CCN(CC2CC2)CC1)C(=O)c1ccccc1
Show InChI InChI=1S/C19H28N2O/c1-20(19(22)18-5-3-2-4-6-18)12-9-16-10-13-21(14-11-16)15-17-7-8-17/h2-6,16-17H,7-15H2,1H3
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n/an/a 3.80E+4n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9414
PNG
(CHEMBL127097 | N-methyl-N-(2-{1-[(4-methylphenyl)m...)
Show SMILES CN(CCC1CCN(Cc2ccc(C)cc2)CC1)C(=O)c1ccccc1
Show InChI InChI=1S/C23H30N2O/c1-19-8-10-21(11-9-19)18-25-16-13-20(14-17-25)12-15-24(2)23(26)22-6-4-3-5-7-22/h3-11,20H,12-18H2,1-2H3
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n/an/a 4.10E+4n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM9420
PNG
(N-[2-(1-benzoylpiperidin-4-yl)ethyl]-N-methylbenza...)
Show SMILES CN(CCC1CCN(CC1)C(=O)c1ccccc1)C(=O)c1ccccc1
Show InChI InChI=1S/C22H26N2O2/c1-23(21(25)19-8-4-2-5-9-19)15-12-18-13-16-24(17-14-18)22(26)20-10-6-3-7-11-20/h2-11,18H,12-17H2,1H3
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n/an/a 5.20E+4n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))
BDBM50407945
PNG
(CHEMBL127398)
Show SMILES O=C(NCCC1CCN(C\C=C\c2ccccc2)CC1)c1ccccc1
Show InChI InChI=1S/C23H28N2O/c26-23(22-11-5-2-6-12-22)24-16-13-21-14-18-25(19-15-21)17-7-10-20-8-3-1-4-9-20/h1-12,21H,13-19H2,(H,24,26)/b10-7+
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n/an/a 5.40E+4n/an/an/an/an/an/a



University of Missouri-St. Louis

Curated by ChEMBL


Assay Description
Inhibition against Acetylcholinesterase (AChE)


J Med Chem 39: 380-7 (1996)


Article DOI: 10.1021/jm950704x
BindingDB Entry DOI: 10.7270/Q25D8T1Q
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%