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Compile Data Set for Download or QSAR

Found 52 hits with Last Name = 'kawakami' and Initial = 'y'   
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


(Tetronarce californica (Pacific electric ray) (Tor...)		BDBM50422179
PNG
(CHEMBL2093912)
Show SMILES COc1cc2C[C@H](CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC |r|
Show InChI InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3/t20-/m0/s1
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 9.5n/an/an/an/an/an/an/an/a



Eisai Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase

J Med Chem 39: 4460-70 (1996)


Article DOI: 10.1021/jm950596e
BindingDB Entry DOI: 10.7270/Q2HD7WB9
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)		BDBM50422179
PNG
(CHEMBL2093912)
Show SMILES COc1cc2C[C@H](CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC |r|
Show InChI InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3/t20-/m0/s1
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 9.5n/an/an/an/an/an/an/an/a



Eisai Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase

J Med Chem 39: 4460-70 (1996)


Article DOI: 10.1021/jm950596e
BindingDB Entry DOI: 10.7270/Q2HD7WB9
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)		BDBM50422179
PNG
(CHEMBL2093912)
Show SMILES COc1cc2C[C@H](CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC |r|
Show InChI InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3/t20-/m0/s1
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 17.5n/an/an/an/an/an/an/an/a



Eisai Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity was calculated for the model Acetylcholinesterase (Expt-1)

J Med Chem 39: 4460-70 (1996)


Article DOI: 10.1021/jm950596e
BindingDB Entry DOI: 10.7270/Q2HD7WB9
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)		BDBM50422179
PNG
(CHEMBL2093912)
Show SMILES COc1cc2C[C@H](CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC |r|
Show InChI InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3/t20-/m0/s1
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 18n/an/an/an/an/an/an/an/a



Eisai Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity was calculated for the model Acetylcholinesterase (Expt-1)

J Med Chem 39: 4460-70 (1996)


Article DOI: 10.1021/jm950596e
BindingDB Entry DOI: 10.7270/Q2HD7WB9
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)		BDBM50029941
PNG
(2-[2-(1-Benzyl-piperidin-4-yl)-ethyl]-5,6-dimethox...)
Show SMILES COc1cc2CC(CCC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC
Show InChI InChI=1S/C25H31NO3/c1-28-23-15-21-14-20(25(27)22(21)16-24(23)29-2)9-8-18-10-12-26(13-11-18)17-19-6-4-3-5-7-19/h3-7,15-16,18,20H,8-14,17H2,1-2H3
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 19n/an/an/an/an/an/an/an/a



Eisai Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity was calculated for the model Acetylcholinesterase (Expt-1)

J Med Chem 39: 4460-70 (1996)


Article DOI: 10.1021/jm950596e
BindingDB Entry DOI: 10.7270/Q2HD7WB9
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)		BDBM50029941
PNG
(2-[2-(1-Benzyl-piperidin-4-yl)-ethyl]-5,6-dimethox...)
Show SMILES COc1cc2CC(CCC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC
Show InChI InChI=1S/C25H31NO3/c1-28-23-15-21-14-20(25(27)22(21)16-24(23)29-2)9-8-18-10-12-26(13-11-18)17-19-6-4-3-5-7-19/h3-7,15-16,18,20H,8-14,17H2,1-2H3
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 27n/an/an/an/an/an/an/an/a



Eisai Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase

J Med Chem 39: 4460-70 (1996)


Article DOI: 10.1021/jm950596e
BindingDB Entry DOI: 10.7270/Q2HD7WB9
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)		BDBM50422179
PNG
(CHEMBL2093912)
Show SMILES COc1cc2C[C@H](CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC |r|
Show InChI InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3/t20-/m0/s1
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 37.6n/an/an/an/an/an/an/an/a



Eisai Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity was calculated for the model Acetylcholinesterase (Expt-2)

J Med Chem 39: 4460-70 (1996)


Article DOI: 10.1021/jm950596e
BindingDB Entry DOI: 10.7270/Q2HD7WB9
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)		BDBM50422179
PNG
(CHEMBL2093912)
Show SMILES COc1cc2C[C@H](CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC |r|
Show InChI InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3/t20-/m0/s1
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 38n/an/an/an/an/an/an/an/a



Eisai Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity was calculated for the model Acetylcholinesterase (Expt-2)

J Med Chem 39: 4460-70 (1996)


Article DOI: 10.1021/jm950596e
BindingDB Entry DOI: 10.7270/Q2HD7WB9
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)		BDBM50029941
PNG
(2-[2-(1-Benzyl-piperidin-4-yl)-ethyl]-5,6-dimethox...)
Show SMILES COc1cc2CC(CCC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC
Show InChI InChI=1S/C25H31NO3/c1-28-23-15-21-14-20(25(27)22(21)16-24(23)29-2)9-8-18-10-12-26(13-11-18)17-19-6-4-3-5-7-19/h3-7,15-16,18,20H,8-14,17H2,1-2H3
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 47n/an/an/an/an/an/an/an/a



Eisai Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity was calculated for the model Acetylcholinesterase (Expt-2)

J Med Chem 39: 4460-70 (1996)


Article DOI: 10.1021/jm950596e
BindingDB Entry DOI: 10.7270/Q2HD7WB9
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)		BDBM50029912
PNG
(2-(1-Benzyl-piperidin-4-yl)-5,6-dimethoxy-indan-1-...)
Show SMILES COc1cc2CC(C3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC
Show InChI InChI=1S/C23H27NO3/c1-26-21-13-18-12-19(23(25)20(18)14-22(21)27-2)17-8-10-24(11-9-17)15-16-6-4-3-5-7-16/h3-7,13-14,17,19H,8-12,15H2,1-2H3
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 54n/an/an/an/an/an/an/an/a



Eisai Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase

J Med Chem 39: 4460-70 (1996)


Article DOI: 10.1021/jm950596e
BindingDB Entry DOI: 10.7270/Q2HD7WB9
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)		BDBM50029912
PNG
(2-(1-Benzyl-piperidin-4-yl)-5,6-dimethoxy-indan-1-...)
Show SMILES COc1cc2CC(C3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC
Show InChI InChI=1S/C23H27NO3/c1-26-21-13-18-12-19(23(25)20(18)14-22(21)27-2)17-8-10-24(11-9-17)15-16-6-4-3-5-7-16/h3-7,13-14,17,19H,8-12,15H2,1-2H3
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 54n/an/an/an/an/an/an/an/a



Eisai Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity was calculated for the model Acetylcholinesterase (Expt-2)

J Med Chem 39: 4460-70 (1996)


Article DOI: 10.1021/jm950596e
BindingDB Entry DOI: 10.7270/Q2HD7WB9
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)		BDBM50029912
PNG
(2-(1-Benzyl-piperidin-4-yl)-5,6-dimethoxy-indan-1-...)
Show SMILES COc1cc2CC(C3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC
Show InChI InChI=1S/C23H27NO3/c1-26-21-13-18-12-19(23(25)20(18)14-22(21)27-2)17-8-10-24(11-9-17)15-16-6-4-3-5-7-16/h3-7,13-14,17,19H,8-12,15H2,1-2H3
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 122n/an/an/an/an/an/an/an/a



Eisai Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity was calculated for the model Acetylcholinesterase (Expt-1)

J Med Chem 39: 4460-70 (1996)


Article DOI: 10.1021/jm950596e
BindingDB Entry DOI: 10.7270/Q2HD7WB9
More data for this
Ligand-Target Pair
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 0.300n/an/an/an/an/an/a



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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 29n/an/an/an/a7.425



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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 35n/an/an/an/an/an/a



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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 39n/an/an/an/an/an/a



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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 51n/an/an/an/a7.425



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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 55n/an/an/an/a7.425



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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 69n/an/an/an/an/an/a



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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 85n/an/an/an/a7.425



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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 88n/an/an/an/a7.425



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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/a7.425



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM9401
PNG
(4-{[2-(1-benzylpiperidin-4-yl)ethyl]carbamoyl}-1-o...)
Show SMILES [O-][n+]1ccc(cc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C20H25N3O2/c24-20(19-9-14-23(25)15-10-19)21-11-6-17-7-12-22(13-8-17)16-18-4-2-1-3-5-18/h1-5,9-10,14-15,17H,6-8,11-13,16H2,(H,21,24)
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n/an/a 155n/an/an/an/an/an/a



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Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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/a7.425



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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/a7.425



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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/a7.425



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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/a7.425



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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/a7.425



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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 770n/an/an/an/an/an/a



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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/a7.425



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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 880n/an/an/an/a7.425



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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/a7.425



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM9418
PNG
(N-methyl-N-{2-[1-(2-phenylethyl)piperidin-4-yl]eth...)
Show SMILES CN(CCC1CCN(CCc2ccccc2)CC1)C(=O)c1ccccc1
Show InChI InChI=1S/C23H30N2O/c1-24(23(26)22-10-6-3-7-11-22)16-12-21-14-18-25(19-15-21)17-13-20-8-4-2-5-9-20/h2-11,21H,12-19H2,1H3
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n/an/a 1.30E+4n/an/an/an/an/an/a



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM9424
PNG
(N-{2-[1-(adamantan-1-ylmethyl)piperidin-4-yl]ethyl...)
Show SMILES CN(CCC1CCN(CC23CC4CC(CC(C4)C2)C3)CC1)C(=O)c1ccccc1 |TLB:12:13:17:10.11.16,16:11:18:17.15.14,16:15:18:10.11.12,THB:12:11:17:18.13.14,14:13:10:17.16.15,14:15:10:18.12.13|
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



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM9421
PNG
((2E)-but-2-enedioic acid; N-methyl-N-[2-(piperidin...)
Show SMILES CN(CCC1CCNCC1)C(=O)c1ccccc1
Show InChI InChI=1S/C15H22N2O/c1-17(12-9-13-7-10-16-11-8-13)15(18)14-5-3-2-4-6-14/h2-6,13,16H,7-12H2,1H3
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n/an/a 2.60E+4n/an/an/an/an/an/a



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
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



Tsukuba Research Laboratories



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM9404
PNG
(Piperidine Derivative 12 | benzyl[2-(1-benzylpiper...)
Show SMILES C(CC1CCN(Cc2ccccc2)CC1)NCc1ccccc1
Show InChI InChI=1S/C21H28N2/c1-3-7-20(8-4-1)17-22-14-11-19-12-15-23(16-13-19)18-21-9-5-2-6-10-21/h1-10,19,22H,11-18H2
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n/an/a 4.60E+4n/an/an/an/an/an/a



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Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. The amount of a yellow substance formed after incubation was d...

J Med Chem 33: 1880-7 (1990)


Article DOI: 10.1021/jm00169a008
BindingDB Entry DOI: 10.7270/Q20Z71H2
More data for this
Ligand-Target Pair
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