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PubMed code 2202827

Compile data set for download or QSAR
Found 55 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
Cholinesterases


(Homo sapiens (Human))
BDBM50014113
PNG
(3alpha,8-dimethyl-1-phenethyl-1,2,3,3alpha,8,8alph...)
Show SMILES CNC(=O)Oc1ccc2N(C)[C@H]3N(CCc4ccccc4)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C22H27N3O2/c1-22-12-14-25(13-11-16-7-5-4-6-8-16)20(22)24(3)19-10-9-17(15-18(19)22)27-21(26)23-2/h4-10,15,20H,11-14H2,1-3H3,(H,23,26)/t20-,22-/m0/s1
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n/an/a 2n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Butyrylcholinesterase in plasma


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014110
PNG
(CHEMBL307721 | Methyl-carbamic acid 1-allyl-3a,8-d...)
Show SMILES CNC(=O)Oc1ccc2N(C)[C@H]3N(CC=C)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C17H23N3O2/c1-5-9-20-10-8-17(2)13-11-12(22-16(21)18-3)6-7-14(13)19(4)15(17)20/h5-7,11,15H,1,8-10H2,2-4H3,(H,18,21)/t15-,17-/m0/s1
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n/an/a 3n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Butyrylcholinesterase in cortex


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014111
PNG
(CHEMBL305670 | Methyl-carbamic acid 3a,8-dimethyl-...)
Show SMILES CNC(=O)Oc1ccc2N(C)[C@H]3NCC[C@@]3(C)c2c1
Show InChI InChI=1S/C14H19N3O2/c1-14-6-7-16-12(14)17(3)11-5-4-9(8-10(11)14)19-13(18)15-2/h4-5,8,12,16H,6-7H2,1-3H3,(H,15,18)/t12-,14+/m1/s1
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n/an/a 3n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in cortex


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014109
PNG
((-)-Octyl-carbamic acid 1,3a,8-trimethyl-1,2,3,3a,...)
Show SMILES CCCCCCCCNC(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C22H35N3O2/c1-5-6-7-8-9-10-14-23-21(26)27-17-11-12-19-18(16-17)22(2)13-15-24(3)20(22)25(19)4/h11-12,16,20H,5-10,13-15H2,1-4H3,(H,23,26)/t20-,22+/m1/s1
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n/an/a 4n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Butyrylcholinesterase in plasma


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014113
PNG
(3alpha,8-dimethyl-1-phenethyl-1,2,3,3alpha,8,8alph...)
Show SMILES CNC(=O)Oc1ccc2N(C)[C@H]3N(CCc4ccccc4)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C22H27N3O2/c1-22-12-14-25(13-11-16-7-5-4-6-8-16)20(22)24(3)19-10-9-17(15-18(19)22)27-21(26)23-2/h4-10,15,20H,11-14H2,1-3H3,(H,23,26)/t20-,22-/m0/s1
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n/an/a 7n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Butyrylcholinesterase in cortex


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014109
PNG
((-)-Octyl-carbamic acid 1,3a,8-trimethyl-1,2,3,3a,...)
Show SMILES CCCCCCCCNC(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C22H35N3O2/c1-5-6-7-8-9-10-14-23-21(26)27-17-11-12-19-18(16-17)22(2)13-15-24(3)20(22)25(19)4/h11-12,16,20H,5-10,13-15H2,1-4H3,(H,23,26)/t20-,22+/m1/s1
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n/an/a 9n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in erythrocyte


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014112
PNG
(CHEMBL74257 | Methyl-carbamic acid 1-benzyl-3a,8-d...)
Show SMILES CNC(=O)Oc1ccc2N(C)[C@H]3N(Cc4ccccc4)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C21H25N3O2/c1-21-11-12-24(14-15-7-5-4-6-8-15)19(21)23(3)18-10-9-16(13-17(18)21)26-20(25)22-2/h4-10,13,19H,11-12,14H2,1-3H3,(H,22,25)/t19-,21-/m0/s1
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n/an/a 10n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Butyrylcholinesterase in cortex


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014109
PNG
((-)-Octyl-carbamic acid 1,3a,8-trimethyl-1,2,3,3a,...)
Show SMILES CCCCCCCCNC(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C22H35N3O2/c1-5-6-7-8-9-10-14-23-21(26)27-17-11-12-19-18(16-17)22(2)13-15-24(3)20(22)25(19)4/h11-12,16,20H,5-10,13-15H2,1-4H3,(H,23,26)/t20-,22+/m1/s1
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n/an/a 15n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in cortex


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
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 15n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in electric eel


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014110
PNG
(CHEMBL307721 | Methyl-carbamic acid 1-allyl-3a,8-d...)
Show SMILES CNC(=O)Oc1ccc2N(C)[C@H]3N(CC=C)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C17H23N3O2/c1-5-9-20-10-8-17(2)13-11-12(22-16(21)18-3)6-7-14(13)19(4)15(17)20/h5-7,11,15H,1,8-10H2,2-4H3,(H,18,21)/t15-,17-/m0/s1
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n/an/a 16n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Butyrylcholinesterase in cortex


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014109
PNG
((-)-Octyl-carbamic acid 1,3a,8-trimethyl-1,2,3,3a,...)
Show SMILES CCCCCCCCNC(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C22H35N3O2/c1-5-6-7-8-9-10-14-23-21(26)27-17-11-12-19-18(16-17)22(2)13-15-24(3)20(22)25(19)4/h11-12,16,20H,5-10,13-15H2,1-4H3,(H,23,26)/t20-,22+/m1/s1
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n/an/a 16n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in erythrocyte


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014111
PNG
(CHEMBL305670 | Methyl-carbamic acid 3a,8-dimethyl-...)
Show SMILES CNC(=O)Oc1ccc2N(C)[C@H]3NCC[C@@]3(C)c2c1
Show InChI InChI=1S/C14H19N3O2/c1-14-6-7-16-12(14)17(3)11-5-4-9(8-10(11)14)19-13(18)15-2/h4-5,8,12,16H,6-7H2,1-3H3,(H,15,18)/t12-,14+/m1/s1
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n/an/a 21n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in erythrocyte


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM10958
PNG
((3aS,8aR)-1,3a,8-trimethyl-1H,2H,3H,3aH,8H,8aH-pyr...)
Show SMILES CN1CC[C@]2(C)[C@H]1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21
Show InChI InChI=1/C20H23N3O2/c1-20-11-12-22(2)18(20)23(3)17-10-9-15(13-16(17)20)25-19(24)21-14-7-5-4-6-8-14/h4-10,13,18H,11-12H2,1-3H3,(H,21,24)/t18-,20+/s2
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n/an/a 21n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in cortex


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014111
PNG
(CHEMBL305670 | Methyl-carbamic acid 3a,8-dimethyl-...)
Show SMILES CNC(=O)Oc1ccc2N(C)[C@H]3NCC[C@@]3(C)c2c1
Show InChI InChI=1S/C14H19N3O2/c1-14-6-7-16-12(14)17(3)11-5-4-9(8-10(11)14)19-13(18)15-2/h4-5,8,12,16H,6-7H2,1-3H3,(H,15,18)/t12-,14+/m1/s1
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n/an/a 23n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Butyrylcholinesterase in cortex


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
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 28n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Butyrylcholinesterase in plasma


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
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 31n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Butyrylcholinesterase in plasma


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014110
PNG
(CHEMBL307721 | Methyl-carbamic acid 1-allyl-3a,8-d...)
Show SMILES CNC(=O)Oc1ccc2N(C)[C@H]3N(CC=C)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C17H23N3O2/c1-5-9-20-10-8-17(2)13-11-12(22-16(21)18-3)6-7-14(13)19(4)15(17)20/h5-7,11,15H,1,8-10H2,2-4H3,(H,18,21)/t15-,17-/m0/s1
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n/an/a 32n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in cortex


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014111
PNG
(CHEMBL305670 | Methyl-carbamic acid 3a,8-dimethyl-...)
Show SMILES CNC(=O)Oc1ccc2N(C)[C@H]3NCC[C@@]3(C)c2c1
Show InChI InChI=1S/C14H19N3O2/c1-14-6-7-16-12(14)17(3)11-5-4-9(8-10(11)14)19-13(18)15-2/h4-5,8,12,16H,6-7H2,1-3H3,(H,15,18)/t12-,14+/m1/s1
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n/an/a 35n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Butyrylcholinesterase in cortex


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
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 35n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in cortex


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM10958
PNG
((3aS,8aR)-1,3a,8-trimethyl-1H,2H,3H,3aH,8H,8aH-pyr...)
Show SMILES CN1CC[C@]2(C)[C@H]1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21
Show InChI InChI=1/C20H23N3O2/c1-20-11-12-22(2)18(20)23(3)17-10-9-15(13-16(17)20)25-19(24)21-14-7-5-4-6-8-14/h4-10,13,18H,11-12H2,1-3H3,(H,21,24)/t18-,20+/s2
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n/an/a 36n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in cortex


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014110
PNG
(CHEMBL307721 | Methyl-carbamic acid 1-allyl-3a,8-d...)
Show SMILES CNC(=O)Oc1ccc2N(C)[C@H]3N(CC=C)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C17H23N3O2/c1-5-9-20-10-8-17(2)13-11-12(22-16(21)18-3)6-7-14(13)19(4)15(17)20/h5-7,11,15H,1,8-10H2,2-4H3,(H,18,21)/t15-,17-/m0/s1
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n/an/a 45n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Butyrylcholinesterase in plasma


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014112
PNG
(CHEMBL74257 | Methyl-carbamic acid 1-benzyl-3a,8-d...)
Show SMILES CNC(=O)Oc1ccc2N(C)[C@H]3N(Cc4ccccc4)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C21H25N3O2/c1-21-11-12-24(14-15-7-5-4-6-8-15)19(21)23(3)18-10-9-16(13-17(18)21)26-20(25)22-2/h4-10,13,19H,11-12,14H2,1-3H3,(H,22,25)/t19-,21-/m0/s1
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n/an/a 55n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Butyrylcholinesterase in cortex


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50014111
PNG
(CHEMBL305670 | Methyl-carbamic acid 3a,8-dimethyl-...)
Show SMILES CNC(=O)Oc1ccc2N(C)[C@H]3NCC[C@@]3(C)c2c1
Show InChI InChI=1S/C14H19N3O2/c1-14-6-7-16-12(14)17(3)11-5-4-9(8-10(11)14)19-13(18)15-2/h4-5,8,12,16H,6-7H2,1-3H3,(H,15,18)/t12-,14+/m1/s1
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n/an/a 57n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in electric eel


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50014110
PNG
(CHEMBL307721 | Methyl-carbamic acid 1-allyl-3a,8-d...)
Show SMILES CNC(=O)Oc1ccc2N(C)[C@H]3N(CC=C)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C17H23N3O2/c1-5-9-20-10-8-17(2)13-11-12(22-16(21)18-3)6-7-14(13)19(4)15(17)20/h5-7,11,15H,1,8-10H2,2-4H3,(H,18,21)/t15-,17-/m0/s1
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n/an/a 69n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in electric eel


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014107
PNG
((-)-(4-Methoxy-phenyl)-carbamic acid 1,3a,8-trimet...)
Show SMILES COc1ccc(NC(=O)Oc2ccc3N(C)[C@H]4N(C)CC[C@@]4(C)c3c2)cc1
Show InChI InChI=1S/C21H25N3O3/c1-21-11-12-23(2)19(21)24(3)18-10-9-16(13-17(18)21)27-20(25)22-14-5-7-15(26-4)8-6-14/h5-10,13,19H,11-12H2,1-4H3,(H,22,25)/t19-,21+/m1/s1
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n/an/a 71n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Butyrylcholinesterase in cortex


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50014109
PNG
((-)-Octyl-carbamic acid 1,3a,8-trimethyl-1,2,3,3a,...)
Show SMILES CCCCCCCCNC(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C22H35N3O2/c1-5-6-7-8-9-10-14-23-21(26)27-17-11-12-19-18(16-17)22(2)13-15-24(3)20(22)25(19)4/h11-12,16,20H,5-10,13-15H2,1-4H3,(H,23,26)/t20-,22+/m1/s1
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n/an/a 110n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in electric eel


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
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 129n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in erythrocyte


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014113
PNG
(3alpha,8-dimethyl-1-phenethyl-1,2,3,3alpha,8,8alph...)
Show SMILES CNC(=O)Oc1ccc2N(C)[C@H]3N(CCc4ccccc4)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C22H27N3O2/c1-22-12-14-25(13-11-16-7-5-4-6-8-16)20(22)24(3)19-10-9-17(15-18(19)22)27-21(26)23-2/h4-10,15,20H,11-14H2,1-3H3,(H,23,26)/t20-,22-/m0/s1
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n/an/a 150n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in erythrocyte


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014112
PNG
(CHEMBL74257 | Methyl-carbamic acid 1-benzyl-3a,8-d...)
Show SMILES CNC(=O)Oc1ccc2N(C)[C@H]3N(Cc4ccccc4)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C21H25N3O2/c1-21-11-12-24(14-15-7-5-4-6-8-15)19(21)23(3)18-10-9-16(13-17(18)21)26-20(25)22-2/h4-10,13,19H,11-12,14H2,1-3H3,(H,22,25)/t19-,21-/m0/s1
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n/an/a 190n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in cortex


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM10984
PNG
((3aS,8aR)-1,3a,8-trimethyl-1H,2H,3H,3aH,8H,8aH-pyr...)
Show SMILES CN(C)C(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1
Show InChI InChI=1/C16H23N3O2/c1-16-8-9-18(4)14(16)19(5)13-7-6-11(10-12(13)16)21-15(20)17(2)3/h6-7,10,14H,8-9H2,1-5H3/t14-,16+/s2
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n/an/a 210n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in erythrocyte


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014113
PNG
(3alpha,8-dimethyl-1-phenethyl-1,2,3,3alpha,8,8alph...)
Show SMILES CNC(=O)Oc1ccc2N(C)[C@H]3N(CCc4ccccc4)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C22H27N3O2/c1-22-12-14-25(13-11-16-7-5-4-6-8-16)20(22)24(3)19-10-9-17(15-18(19)22)27-21(26)23-2/h4-10,15,20H,11-14H2,1-3H3,(H,23,26)/t20-,22-/m0/s1
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n/an/a 220n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in erythrocyte


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014107
PNG
((-)-(4-Methoxy-phenyl)-carbamic acid 1,3a,8-trimet...)
Show SMILES COc1ccc(NC(=O)Oc2ccc3N(C)[C@H]4N(C)CC[C@@]4(C)c3c2)cc1
Show InChI InChI=1S/C21H25N3O3/c1-21-11-12-23(2)19(21)24(3)18-10-9-16(13-17(18)21)27-20(25)22-14-5-7-15(26-4)8-6-14/h5-10,13,19H,11-12H2,1-4H3,(H,22,25)/t19-,21+/m1/s1
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n/an/a 230n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Butyrylcholinesterase in cortex


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014107
PNG
((-)-(4-Methoxy-phenyl)-carbamic acid 1,3a,8-trimet...)
Show SMILES COc1ccc(NC(=O)Oc2ccc3N(C)[C@H]4N(C)CC[C@@]4(C)c3c2)cc1
Show InChI InChI=1S/C21H25N3O3/c1-21-11-12-23(2)19(21)24(3)18-10-9-16(13-17(18)21)27-20(25)22-14-5-7-15(26-4)8-6-14/h5-10,13,19H,11-12H2,1-4H3,(H,22,25)/t19-,21+/m1/s1
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n/an/a 230n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in cortex


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM10984
PNG
((3aS,8aR)-1,3a,8-trimethyl-1H,2H,3H,3aH,8H,8aH-pyr...)
Show SMILES CN(C)C(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1
Show InChI InChI=1/C16H23N3O2/c1-16-8-9-18(4)14(16)19(5)13-7-6-11(10-12(13)16)21-15(20)17(2)3/h6-7,10,14H,8-9H2,1-5H3/t14-,16+/s2
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n/an/a 310n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Butyrylcholinesterase in plasma


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014112
PNG
(CHEMBL74257 | Methyl-carbamic acid 1-benzyl-3a,8-d...)
Show SMILES CNC(=O)Oc1ccc2N(C)[C@H]3N(Cc4ccccc4)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C21H25N3O2/c1-21-11-12-24(14-15-7-5-4-6-8-15)19(21)23(3)18-10-9-16(13-17(18)21)26-20(25)22-2/h4-10,13,19H,11-12,14H2,1-3H3,(H,22,25)/t19-,21-/m0/s1
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n/an/a 330n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in erythrocyte


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014107
PNG
((-)-(4-Methoxy-phenyl)-carbamic acid 1,3a,8-trimet...)
Show SMILES COc1ccc(NC(=O)Oc2ccc3N(C)[C@H]4N(C)CC[C@@]4(C)c3c2)cc1
Show InChI InChI=1S/C21H25N3O3/c1-21-11-12-23(2)19(21)24(3)18-10-9-16(13-17(18)21)27-20(25)22-14-5-7-15(26-4)8-6-14/h5-10,13,19H,11-12H2,1-4H3,(H,22,25)/t19-,21+/m1/s1
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n/an/a 350n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in cortex


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM10958
PNG
((3aS,8aR)-1,3a,8-trimethyl-1H,2H,3H,3aH,8H,8aH-pyr...)
Show SMILES CN1CC[C@]2(C)[C@H]1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21
Show InChI InChI=1/C20H23N3O2/c1-20-11-12-22(2)18(20)23(3)17-10-9-15(13-16(17)20)25-19(24)21-14-7-5-4-6-8-14/h4-10,13,18H,11-12H2,1-3H3,(H,21,24)/t18-,20+/s2
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n/an/a 350n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in electric eel


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM10984
PNG
((3aS,8aR)-1,3a,8-trimethyl-1H,2H,3H,3aH,8H,8aH-pyr...)
Show SMILES CN(C)C(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1
Show InChI InChI=1/C16H23N3O2/c1-16-8-9-18(4)14(16)19(5)13-7-6-11(10-12(13)16)21-15(20)17(2)3/h6-7,10,14H,8-9H2,1-5H3/t14-,16+/s2
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n/an/a 420n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Butyrylcholinesterase in plasma


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM10984
PNG
((3aS,8aR)-1,3a,8-trimethyl-1H,2H,3H,3aH,8H,8aH-pyr...)
Show SMILES CN(C)C(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1
Show InChI InChI=1/C16H23N3O2/c1-16-8-9-18(4)14(16)19(5)13-7-6-11(10-12(13)16)21-15(20)17(2)3/h6-7,10,14H,8-9H2,1-5H3/t14-,16+/s2
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n/an/a 970n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in electric eel


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50014113
PNG
(3alpha,8-dimethyl-1-phenethyl-1,2,3,3alpha,8,8alph...)
Show SMILES CNC(=O)Oc1ccc2N(C)[C@H]3N(CCc4ccccc4)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C22H27N3O2/c1-22-12-14-25(13-11-16-7-5-4-6-8-16)20(22)24(3)19-10-9-17(15-18(19)22)27-21(26)23-2/h4-10,15,20H,11-14H2,1-3H3,(H,23,26)/t20-,22-/m0/s1
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n/an/a 1.00E+3n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in electric eel


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50014112
PNG
(CHEMBL74257 | Methyl-carbamic acid 1-benzyl-3a,8-d...)
Show SMILES CNC(=O)Oc1ccc2N(C)[C@H]3N(Cc4ccccc4)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C21H25N3O2/c1-21-11-12-24(14-15-7-5-4-6-8-15)19(21)23(3)18-10-9-16(13-17(18)21)26-20(25)22-2/h4-10,13,19H,11-12,14H2,1-3H3,(H,22,25)/t19-,21-/m0/s1
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n/an/a 1.00E+3n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in electric eel


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM10958
PNG
((3aS,8aR)-1,3a,8-trimethyl-1H,2H,3H,3aH,8H,8aH-pyr...)
Show SMILES CN1CC[C@]2(C)[C@H]1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21
Show InChI InChI=1/C20H23N3O2/c1-20-11-12-22(2)18(20)23(3)17-10-9-15(13-16(17)20)25-19(24)21-14-7-5-4-6-8-14/h4-10,13,18H,11-12H2,1-3H3,(H,21,24)/t18-,20+/s2
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n/an/a 1.30E+3n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Butyrylcholinesterase in plasma


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50014107
PNG
((-)-(4-Methoxy-phenyl)-carbamic acid 1,3a,8-trimet...)
Show SMILES COc1ccc(NC(=O)Oc2ccc3N(C)[C@H]4N(C)CC[C@@]4(C)c3c2)cc1
Show InChI InChI=1S/C21H25N3O3/c1-21-11-12-23(2)19(21)24(3)18-10-9-16(13-17(18)21)27-20(25)22-14-5-7-15(26-4)8-6-14/h5-10,13,19H,11-12H2,1-4H3,(H,22,25)/t19-,21+/m1/s1
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n/an/a 1.70E+3n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in electric eel


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014108
PNG
((-)-tert-Butyl-carbamic acid 1,3a,8-trimethyl-1,2,...)
Show SMILES CN1CC[C@]2(C)[C@H]1N(C)c1ccc(OC(=O)NC(C)(C)C)cc21
Show InChI InChI=1S/C18H27N3O2/c1-17(2,3)19-16(22)23-12-7-8-14-13(11-12)18(4)9-10-20(5)15(18)21(14)6/h7-8,11,15H,9-10H2,1-6H3,(H,19,22)/t15-,18+/m1/s1
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n/an/a 2.00E+3n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Butyrylcholinesterase in plasma


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM10958
PNG
((3aS,8aR)-1,3a,8-trimethyl-1H,2H,3H,3aH,8H,8aH-pyr...)
Show SMILES CN1CC[C@]2(C)[C@H]1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21
Show InChI InChI=1/C20H23N3O2/c1-20-11-12-22(2)18(20)23(3)17-10-9-15(13-16(17)20)25-19(24)21-14-7-5-4-6-8-14/h4-10,13,18H,11-12H2,1-3H3,(H,21,24)/t18-,20+/s2
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n/an/a 2.50E+3n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in cortex


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM10984
PNG
((3aS,8aR)-1,3a,8-trimethyl-1H,2H,3H,3aH,8H,8aH-pyr...)
Show SMILES CN(C)C(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1
Show InChI InChI=1/C16H23N3O2/c1-16-8-9-18(4)14(16)19(5)13-7-6-11(10-12(13)16)21-15(20)17(2)3/h6-7,10,14H,8-9H2,1-5H3/t14-,16+/s2
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n/an/a 3.00E+3n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Butyrylcholinesterase in plasma


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
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 4.00E+3n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Butyrylcholinesterase in plasma


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50014108
PNG
((-)-tert-Butyl-carbamic acid 1,3a,8-trimethyl-1,2,...)
Show SMILES CN1CC[C@]2(C)[C@H]1N(C)c1ccc(OC(=O)NC(C)(C)C)cc21
Show InChI InChI=1S/C18H27N3O2/c1-17(2,3)19-16(22)23-12-7-8-14-13(11-12)18(4)9-10-20(5)15(18)21(14)6/h7-8,11,15H,9-10H2,1-6H3,(H,19,22)/t15-,18+/m1/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in electric eel


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014108
PNG
((-)-tert-Butyl-carbamic acid 1,3a,8-trimethyl-1,2,...)
Show SMILES CN1CC[C@]2(C)[C@H]1N(C)c1ccc(OC(=O)NC(C)(C)C)cc21
Show InChI InChI=1S/C18H27N3O2/c1-17(2,3)19-16(22)23-12-7-8-14-13(11-12)18(4)9-10-20(5)15(18)21(14)6/h7-8,11,15H,9-10H2,1-6H3,(H,19,22)/t15-,18+/m1/s1
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n/an/a 1.10E+4n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Butyrylcholinesterase in cortex


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
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 2.20E+4n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in erythrocyte


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014108
PNG
((-)-tert-Butyl-carbamic acid 1,3a,8-trimethyl-1,2,...)
Show SMILES CN1CC[C@]2(C)[C@H]1N(C)c1ccc(OC(=O)NC(C)(C)C)cc21
Show InChI InChI=1S/C18H27N3O2/c1-17(2,3)19-16(22)23-12-7-8-14-13(11-12)18(4)9-10-20(5)15(18)21(14)6/h7-8,11,15H,9-10H2,1-6H3,(H,19,22)/t15-,18+/m1/s1
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n/an/a 2.30E+4n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Butyrylcholinesterase in plasma


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
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 2.50E+4n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in erythrocyte


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
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 2.60E+4n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Butyrylcholinesterase in cortex


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Cholinesterases


(Homo sapiens (Human))
BDBM50014108
PNG
((-)-tert-Butyl-carbamic acid 1,3a,8-trimethyl-1,2,...)
Show SMILES CN1CC[C@]2(C)[C@H]1N(C)c1ccc(OC(=O)NC(C)(C)C)cc21
Show InChI InChI=1S/C18H27N3O2/c1-17(2,3)19-16(22)23-12-7-8-14-13(11-12)18(4)9-10-20(5)15(18)21(14)6/h7-8,11,15H,9-10H2,1-6H3,(H,19,22)/t15-,18+/m1/s1
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n/an/a 3.20E+4n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in cortex


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
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 5.30E+4n/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase in electric eel


J Med Chem 33: 2311-9 (1990)


Article DOI: 10.1021/jm00171a001
BindingDB Entry DOI: 10.7270/Q24M93HF
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%