BindingDB logo
myBDB logout

PubMed code 19493592

Compile data set for download or QSAR
Found 30 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


(Rattus norvegicus (rat))
BDBM50022775
PNG
((m-Hydroxyphenyl)trimethylammonium dimethylcarbama...)
Show SMILES CN(C)C(=O)Oc1cccc(c1)[N+](C)(C)C
Show InChI InChI=1S/C12H19N2O2/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5/h6-9H,1-5H3/q+1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MCE
KEGG
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 40n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of Wistar rat brain homogenate AChE by Ellman's assay


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50022775
PNG
((m-Hydroxyphenyl)trimethylammonium dimethylcarbama...)
Show SMILES CN(C)C(=O)Oc1cccc(c1)[N+](C)(C)C
Show InChI InChI=1S/C12H19N2O2/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5/h6-9H,1-5H3/q+1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MCE
KEGG
PC cid
PC sid
UniChem

Patents


Similars

DrugBank
Article
PubMed
n/an/a 41n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of human serum AChE by Ellman's assay


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50022775
PNG
((m-Hydroxyphenyl)trimethylammonium dimethylcarbama...)
Show SMILES CN(C)C(=O)Oc1cccc(c1)[N+](C)(C)C
Show InChI InChI=1S/C12H19N2O2/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5/h6-9H,1-5H3/q+1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MCE
KEGG
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 53n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


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


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50298426
PNG
(1-(2,5-dichloro benzene)-sulfonyl-cis-2,6-dimethyl...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1cc(Cl)ccc1Cl |r|
Show InChI InChI=1S/C13H17Cl2NO2S/c1-9-4-3-5-10(2)16(9)19(17,18)13-8-11(14)6-7-12(13)15/h6-10H,3-5H2,1-2H3/t9-,10+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 75n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of Wistar rat brain homogenate AChE by Ellman's assay


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50298421
PNG
(CHEMBL576005 | cis-2,6-dimethyl-1-methyl sulfonyl ...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(C)(=O)=O |r|
Show InChI InChI=1S/C8H17NO2S/c1-7-5-4-6-8(2)9(7)12(3,10)11/h7-8H,4-6H2,1-3H3/t7-,8+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 75n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of human serum AChE by Ellman's assay


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50298426
PNG
(1-(2,5-dichloro benzene)-sulfonyl-cis-2,6-dimethyl...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1cc(Cl)ccc1Cl |r|
Show InChI InChI=1S/C13H17Cl2NO2S/c1-9-4-3-5-10(2)16(9)19(17,18)13-8-11(14)6-7-12(13)15/h6-10H,3-5H2,1-2H3/t9-,10+
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 81n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


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


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50298421
PNG
(CHEMBL576005 | cis-2,6-dimethyl-1-methyl sulfonyl ...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(C)(=O)=O |r|
Show InChI InChI=1S/C8H17NO2S/c1-7-5-4-6-8(2)9(7)12(3,10)11/h7-8H,4-6H2,1-3H3/t7-,8+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 85n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of Wistar rat brain homogenate AChE by Ellman's assay


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50298421
PNG
(CHEMBL576005 | cis-2,6-dimethyl-1-methyl sulfonyl ...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(C)(=O)=O |r|
Show InChI InChI=1S/C8H17NO2S/c1-7-5-4-6-8(2)9(7)12(3,10)11/h7-8H,4-6H2,1-3H3/t7-,8+
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 90n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


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


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50298426
PNG
(1-(2,5-dichloro benzene)-sulfonyl-cis-2,6-dimethyl...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1cc(Cl)ccc1Cl |r|
Show InChI InChI=1S/C13H17Cl2NO2S/c1-9-4-3-5-10(2)16(9)19(17,18)13-8-11(14)6-7-12(13)15/h6-10H,3-5H2,1-2H3/t9-,10+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 90n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of human serum AChE by Ellman's assay


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50298427
PNG
(1-(2-nitro benzene)-sulfonyl-cis-2,6-dimethylpiper...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1ccccc1[N+]([O-])=O |r|
Show InChI InChI=1S/C13H18N2O4S/c1-10-6-5-7-11(2)14(10)20(18,19)13-9-4-3-8-12(13)15(16)17/h3-4,8-11H,5-7H2,1-2H3/t10-,11+
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 180n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


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


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50298427
PNG
(1-(2-nitro benzene)-sulfonyl-cis-2,6-dimethylpiper...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1ccccc1[N+]([O-])=O |r|
Show InChI InChI=1S/C13H18N2O4S/c1-10-6-5-7-11(2)14(10)20(18,19)13-9-4-3-8-12(13)15(16)17/h3-4,8-11H,5-7H2,1-2H3/t10-,11+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 185n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of human serum AChE by Ellman's assay


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50298428
PNG
(1-(3-nitro benzene)-sulfonyl-cis-2,6-dimethylpiper...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1cccc(c1)[N+]([O-])=O |r|
Show InChI InChI=1S/C13H18N2O4S/c1-10-5-3-6-11(2)14(10)20(18,19)13-8-4-7-12(9-13)15(16)17/h4,7-11H,3,5-6H2,1-2H3/t10-,11+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 186n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of Wistar rat brain homogenate AChE by Ellman's assay


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50298428
PNG
(1-(3-nitro benzene)-sulfonyl-cis-2,6-dimethylpiper...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1cccc(c1)[N+]([O-])=O |r|
Show InChI InChI=1S/C13H18N2O4S/c1-10-5-3-6-11(2)14(10)20(18,19)13-8-4-7-12(9-13)15(16)17/h4,7-11H,3,5-6H2,1-2H3/t10-,11+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 192n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of human serum AChE by Ellman's assay


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50298427
PNG
(1-(2-nitro benzene)-sulfonyl-cis-2,6-dimethylpiper...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1ccccc1[N+]([O-])=O |r|
Show InChI InChI=1S/C13H18N2O4S/c1-10-6-5-7-11(2)14(10)20(18,19)13-9-4-3-8-12(13)15(16)17/h3-4,8-11H,5-7H2,1-2H3/t10-,11+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 195n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of Wistar rat brain homogenate AChE by Ellman's assay


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50298428
PNG
(1-(3-nitro benzene)-sulfonyl-cis-2,6-dimethylpiper...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1cccc(c1)[N+]([O-])=O |r|
Show InChI InChI=1S/C13H18N2O4S/c1-10-5-3-6-11(2)14(10)20(18,19)13-8-4-7-12(9-13)15(16)17/h4,7-11H,3,5-6H2,1-2H3/t10-,11+
UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 200n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


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


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50298425
PNG
((2R,6S)-1-(4-chlorophenylsulfonyl)-2,6-dimethylpip...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1ccc(Cl)cc1 |r|
Show InChI InChI=1S/C13H18ClNO2S/c1-10-4-3-5-11(2)15(10)18(16,17)13-8-6-12(14)7-9-13/h6-11H,3-5H2,1-2H3/t10-,11+
UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 312n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


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


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50298425
PNG
((2R,6S)-1-(4-chlorophenylsulfonyl)-2,6-dimethylpip...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1ccc(Cl)cc1 |r|
Show InChI InChI=1S/C13H18ClNO2S/c1-10-4-3-5-11(2)15(10)18(16,17)13-8-6-12(14)7-9-13/h6-11H,3-5H2,1-2H3/t10-,11+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 318n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of human serum AChE by Ellman's assay


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50298425
PNG
((2R,6S)-1-(4-chlorophenylsulfonyl)-2,6-dimethylpip...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1ccc(Cl)cc1 |r|
Show InChI InChI=1S/C13H18ClNO2S/c1-10-4-3-5-11(2)15(10)18(16,17)13-8-6-12(14)7-9-13/h6-11H,3-5H2,1-2H3/t10-,11+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 325n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of Wistar rat brain homogenate AChE by Ellman's assay


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50298422
PNG
(1-benzene sulfonyl-cis-2,6-dimethyl piperidine | C...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C13H19NO2S/c1-11-7-6-8-12(2)14(11)17(15,16)13-9-4-3-5-10-13/h3-5,9-12H,6-8H2,1-2H3/t11-,12+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 362n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of Wistar rat brain homogenate AChE by Ellman's assay


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50298423
PNG
(1-(4-methyl benzene)-sulfonyl-cis-2,6-dimethylpipe...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1ccc(C)cc1 |r|
Show InChI InChI=1S/C14H21NO2S/c1-11-7-9-14(10-8-11)18(16,17)15-12(2)5-4-6-13(15)3/h7-10,12-13H,4-6H2,1-3H3/t12-,13+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 362n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of Wistar rat brain homogenate AChE by Ellman's assay


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50298423
PNG
(1-(4-methyl benzene)-sulfonyl-cis-2,6-dimethylpipe...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1ccc(C)cc1 |r|
Show InChI InChI=1S/C14H21NO2S/c1-11-7-9-14(10-8-11)18(16,17)15-12(2)5-4-6-13(15)3/h7-10,12-13H,4-6H2,1-3H3/t12-,13+
UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 365n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


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


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50298423
PNG
(1-(4-methyl benzene)-sulfonyl-cis-2,6-dimethylpipe...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1ccc(C)cc1 |r|
Show InChI InChI=1S/C14H21NO2S/c1-11-7-9-14(10-8-11)18(16,17)15-12(2)5-4-6-13(15)3/h7-10,12-13H,4-6H2,1-3H3/t12-,13+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 368n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of human serum AChE by Ellman's assay


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50298422
PNG
(1-benzene sulfonyl-cis-2,6-dimethyl piperidine | C...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C13H19NO2S/c1-11-7-6-8-12(2)14(11)17(15,16)13-9-4-3-5-10-13/h3-5,9-12H,6-8H2,1-2H3/t11-,12+
UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 388n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


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


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50298422
PNG
(1-benzene sulfonyl-cis-2,6-dimethyl piperidine | C...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C13H19NO2S/c1-11-7-6-8-12(2)14(11)17(15,16)13-9-4-3-5-10-13/h3-5,9-12H,6-8H2,1-2H3/t11-,12+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 392n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of human serum AChE by Ellman's assay


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50298424
PNG
(1-(4-tert-butyl benzene)-sulfonyl-cis-2,6-dimethyl...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1ccc(cc1)C(C)(C)C |r|
Show InChI InChI=1S/C17H27NO2S/c1-13-7-6-8-14(2)18(13)21(19,20)16-11-9-15(10-12-16)17(3,4)5/h9-14H,6-8H2,1-5H3/t13-,14+
UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 450n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


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


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50298424
PNG
(1-(4-tert-butyl benzene)-sulfonyl-cis-2,6-dimethyl...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1ccc(cc1)C(C)(C)C |r|
Show InChI InChI=1S/C17H27NO2S/c1-13-7-6-8-14(2)18(13)21(19,20)16-11-9-15(10-12-16)17(3,4)5/h9-14H,6-8H2,1-5H3/t13-,14+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 458n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of human serum AChE by Ellman's assay


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50298424
PNG
(1-(4-tert-butyl benzene)-sulfonyl-cis-2,6-dimethyl...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1ccc(cc1)C(C)(C)C |r|
Show InChI InChI=1S/C17H27NO2S/c1-13-7-6-8-14(2)18(13)21(19,20)16-11-9-15(10-12-16)17(3,4)5/h9-14H,6-8H2,1-5H3/t13-,14+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 463n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of Wistar rat brain homogenate AChE by Ellman's assay


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50298429
PNG
(1-(4-nitro benzene)-sulfonyl-cis-2,6-dimethylpiper...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1ccc(cc1)[N+]([O-])=O |r|
Show InChI InChI=1S/C13H18N2O4S/c1-10-4-3-5-11(2)14(10)20(18,19)13-8-6-12(7-9-13)15(16)17/h6-11H,3-5H2,1-2H3/t10-,11+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.15E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of human serum AChE by Ellman's assay


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50298429
PNG
(1-(4-nitro benzene)-sulfonyl-cis-2,6-dimethylpiper...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1ccc(cc1)[N+]([O-])=O |r|
Show InChI InChI=1S/C13H18N2O4S/c1-10-4-3-5-11(2)14(10)20(18,19)13-8-6-12(7-9-13)15(16)17/h6-11H,3-5H2,1-2H3/t10-,11+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.20E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of Wistar rat brain homogenate AChE by Ellman's assay


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50298429
PNG
(1-(4-nitro benzene)-sulfonyl-cis-2,6-dimethylpiper...)
Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1ccc(cc1)[N+]([O-])=O |r|
Show InChI InChI=1S/C13H18N2O4S/c1-10-4-3-5-11(2)14(10)20(18,19)13-8-6-12(7-9-13)15(16)17/h6-11H,3-5H2,1-2H3/t10-,11+
UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.21E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


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


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%