Found 23 hits of Enzyme Inhibition Constant Data Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50188016
(1-[bis(4-fluoro-phenyl)-methyl]-4-(2-pyrrolidin-1-...)Show SMILES Fc1ccc(cc1)C(N1CCN(CCN2CCCC2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C23H29F2N3/c24-21-7-3-19(4-8-21)23(20-5-9-22(25)10-6-20)28-17-15-27(16-18-28)14-13-26-11-1-2-12-26/h3-10,23H,1-2,11-18H2 | UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 17.6 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mysore
Curated by ChEMBL
| Assay Description Inhibition of electric eel AchE |
Bioorg Med Chem Lett 16: 3932-6 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.030 BindingDB Entry DOI: 10.7270/Q2RJ4J3F |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Rattus norvegicus (rat)) | BDBM50188016
(1-[bis(4-fluoro-phenyl)-methyl]-4-(2-pyrrolidin-1-...)Show SMILES Fc1ccc(cc1)C(N1CCN(CCN2CCCC2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C23H29F2N3/c24-21-7-3-19(4-8-21)23(20-5-9-22(25)10-6-20)28-17-15-27(16-18-28)14-13-26-11-1-2-12-26/h3-10,23H,1-2,11-18H2 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 18.8 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mysore
Curated by ChEMBL
| Assay Description Inhibition of rat brain homogenate AchE |
Bioorg Med Chem Lett 16: 3932-6 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.030 BindingDB Entry DOI: 10.7270/Q2RJ4J3F |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50188016
(1-[bis(4-fluoro-phenyl)-methyl]-4-(2-pyrrolidin-1-...)Show SMILES Fc1ccc(cc1)C(N1CCN(CCN2CCCC2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C23H29F2N3/c24-21-7-3-19(4-8-21)23(20-5-9-22(25)10-6-20)28-17-15-27(16-18-28)14-13-26-11-1-2-12-26/h3-10,23H,1-2,11-18H2 | 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/a | n/a | 21 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mysore
Curated by ChEMBL
| Assay Description Inhibition of human serum AchE |
Bioorg Med Chem Lett 16: 3932-6 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.030 BindingDB Entry DOI: 10.7270/Q2RJ4J3F |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Rattus norvegicus (rat)) | BDBM50022775
((m-Hydroxyphenyl)trimethylammonium dimethylcarbama...)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/a | n/a | 37.5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mysore
Curated by ChEMBL
| Assay Description Inhibition of rat brain homogenate AchE |
Bioorg Med Chem Lett 16: 3932-6 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.030 BindingDB Entry DOI: 10.7270/Q2RJ4J3F |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Rattus norvegicus (rat)) | BDBM50188013
(1-[bis(4-fluoro-phenyl)-methyl]-4-1(benzyl)-4-(2-c...)Show SMILES Fc1ccc(cc1)C(N1CCN(Cc2ccc(cc2)-c2ccccc2C#N)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C31H27F2N3/c32-28-13-9-25(10-14-28)31(26-11-15-29(33)16-12-26)36-19-17-35(18-20-36)22-23-5-7-24(8-6-23)30-4-2-1-3-27(30)21-34/h1-16,31H,17-20,22H2 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 37.5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mysore
Curated by ChEMBL
| Assay Description Inhibition of rat brain homogenate AchE |
Bioorg Med Chem Lett 16: 3932-6 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.030 BindingDB Entry DOI: 10.7270/Q2RJ4J3F |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50022775
((m-Hydroxyphenyl)trimethylammonium dimethylcarbama...)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/a | n/a | 42.1 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mysore
Curated by ChEMBL
| Assay Description Inhibition of human serum AchE |
Bioorg Med Chem Lett 16: 3932-6 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.030 BindingDB Entry DOI: 10.7270/Q2RJ4J3F |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50188013
(1-[bis(4-fluoro-phenyl)-methyl]-4-1(benzyl)-4-(2-c...)Show SMILES Fc1ccc(cc1)C(N1CCN(Cc2ccc(cc2)-c2ccccc2C#N)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C31H27F2N3/c32-28-13-9-25(10-14-28)31(26-11-15-29(33)16-12-26)36-19-17-35(18-20-36)22-23-5-7-24(8-6-23)30-4-2-1-3-27(30)21-34/h1-16,31H,17-20,22H2 | UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 70.5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mysore
Curated by ChEMBL
| Assay Description Inhibition of electric eel AchE |
Bioorg Med Chem Lett 16: 3932-6 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.030 BindingDB Entry DOI: 10.7270/Q2RJ4J3F |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50188013
(1-[bis(4-fluoro-phenyl)-methyl]-4-1(benzyl)-4-(2-c...)Show SMILES Fc1ccc(cc1)C(N1CCN(Cc2ccc(cc2)-c2ccccc2C#N)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C31H27F2N3/c32-28-13-9-25(10-14-28)31(26-11-15-29(33)16-12-26)36-19-17-35(18-20-36)22-23-5-7-24(8-6-23)30-4-2-1-3-27(30)21-34/h1-16,31H,17-20,22H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 73.6 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mysore
Curated by ChEMBL
| Assay Description Inhibition of human serum AchE |
Bioorg Med Chem Lett 16: 3932-6 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.030 BindingDB Entry DOI: 10.7270/Q2RJ4J3F |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Rattus norvegicus (rat)) | BDBM50188011
(1-[bis(4-fluoro-phenyl)-methyl]-4-(2-piperidin-1-y...)Show SMILES Fc1ccc(cc1)C(N1CCN(CCN2CCCCC2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C24H31F2N3/c25-22-8-4-20(5-9-22)24(21-6-10-23(26)11-7-21)29-18-16-28(17-19-29)15-14-27-12-2-1-3-13-27/h4-11,24H,1-3,12-19H2 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 93.8 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mysore
Curated by ChEMBL
| Assay Description Inhibition of rat brain homogenate AchE |
Bioorg Med Chem Lett 16: 3932-6 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.030 BindingDB Entry DOI: 10.7270/Q2RJ4J3F |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50188011
(1-[bis(4-fluoro-phenyl)-methyl]-4-(2-piperidin-1-y...)Show SMILES Fc1ccc(cc1)C(N1CCN(CCN2CCCCC2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C24H31F2N3/c25-22-8-4-20(5-9-22)24(21-6-10-23(26)11-7-21)29-18-16-28(17-19-29)15-14-27-12-2-1-3-13-27/h4-11,24H,1-3,12-19H2 | 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/a | n/a | 126 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mysore
Curated by ChEMBL
| Assay Description Inhibition of human serum AchE |
Bioorg Med Chem Lett 16: 3932-6 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.030 BindingDB Entry DOI: 10.7270/Q2RJ4J3F |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50188011
(1-[bis(4-fluoro-phenyl)-methyl]-4-(2-piperidin-1-y...)Show SMILES Fc1ccc(cc1)C(N1CCN(CCN2CCCCC2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C24H31F2N3/c25-22-8-4-20(5-9-22)24(21-6-10-23(26)11-7-21)29-18-16-28(17-19-29)15-14-27-12-2-1-3-13-27/h4-11,24H,1-3,12-19H2 | UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 135 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mysore
Curated by ChEMBL
| Assay Description Inhibition of electric eel AchE |
Bioorg Med Chem Lett 16: 3932-6 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.030 BindingDB Entry DOI: 10.7270/Q2RJ4J3F |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Rattus norvegicus (rat)) | BDBM50188014
(4-(2-{4-[bis(4-fluoro-phenyl)-methyl]piperazine-1-...)Show SMILES Fc1ccc(cc1)C(N1CCN(CCN2CCOCC2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C23H29F2N3O/c24-21-5-1-19(2-6-21)23(20-3-7-22(25)8-4-20)28-13-11-26(12-14-28)9-10-27-15-17-29-18-16-27/h1-8,23H,9-18H2 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mysore
Curated by ChEMBL
| Assay Description Inhibition of rat brain homogenate AchE |
Bioorg Med Chem Lett 16: 3932-6 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.030 BindingDB Entry DOI: 10.7270/Q2RJ4J3F |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50188014
(4-(2-{4-[bis(4-fluoro-phenyl)-methyl]piperazine-1-...)Show SMILES Fc1ccc(cc1)C(N1CCN(CCN2CCOCC2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C23H29F2N3O/c24-21-5-1-19(2-6-21)23(20-3-7-22(25)8-4-20)28-13-11-26(12-14-28)9-10-27-15-17-29-18-16-27/h1-8,23H,9-18H2 | UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 253 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mysore
Curated by ChEMBL
| Assay Description Inhibition of electric eel AchE |
Bioorg Med Chem Lett 16: 3932-6 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.030 BindingDB Entry DOI: 10.7270/Q2RJ4J3F |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50188014
(4-(2-{4-[bis(4-fluoro-phenyl)-methyl]piperazine-1-...)Show SMILES Fc1ccc(cc1)C(N1CCN(CCN2CCOCC2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C23H29F2N3O/c24-21-5-1-19(2-6-21)23(20-3-7-22(25)8-4-20)28-13-11-26(12-14-28)9-10-27-15-17-29-18-16-27/h1-8,23H,9-18H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 284 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mysore
Curated by ChEMBL
| Assay Description Inhibition of human serum AchE |
Bioorg Med Chem Lett 16: 3932-6 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.030 BindingDB Entry DOI: 10.7270/Q2RJ4J3F |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50188010
(1-[bis(4-fluoro-phenyl)-methyl]-4-(2-bromo-4,5-dim...)Show SMILES COc1cc(Br)c(CN2CCN(CC2)C(c2ccc(F)cc2)c2ccc(F)cc2)cc1OC Show InChI InChI=1S/C26H27BrF2N2O2/c1-32-24-15-20(23(27)16-25(24)33-2)17-30-11-13-31(14-12-30)26(18-3-7-21(28)8-4-18)19-5-9-22(29)10-6-19/h3-10,15-16,26H,11-14,17H2,1-2H3 | UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 715 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mysore
Curated by ChEMBL
| Assay Description Inhibition of electric eel AchE |
Bioorg Med Chem Lett 16: 3932-6 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.030 BindingDB Entry DOI: 10.7270/Q2RJ4J3F |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50188010
(1-[bis(4-fluoro-phenyl)-methyl]-4-(2-bromo-4,5-dim...)Show SMILES COc1cc(Br)c(CN2CCN(CC2)C(c2ccc(F)cc2)c2ccc(F)cc2)cc1OC Show InChI InChI=1S/C26H27BrF2N2O2/c1-32-24-15-20(23(27)16-25(24)33-2)17-30-11-13-31(14-12-30)26(18-3-7-21(28)8-4-18)19-5-9-22(29)10-6-19/h3-10,15-16,26H,11-14,17H2,1-2H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 1.01E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mysore
Curated by ChEMBL
| Assay Description Inhibition of human serum AchE |
Bioorg Med Chem Lett 16: 3932-6 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.030 BindingDB Entry DOI: 10.7270/Q2RJ4J3F |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50188018
(3-(2-{4-[bis(4-fluoro-phenyl)-methyl]-piperazine-1...)Show SMILES Cc1nc2CCCCc2c(O)c1CCN1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1 Show InChI InChI=1S/C29H33F2N3O/c1-20-25(29(35)26-4-2-3-5-27(26)32-20)14-15-33-16-18-34(19-17-33)28(21-6-10-23(30)11-7-21)22-8-12-24(31)13-9-22/h6-13,28H,2-5,14-19H2,1H3,(H,32,35) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 1.07E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mysore
Curated by ChEMBL
| Assay Description Inhibition of human serum AchE |
Bioorg Med Chem Lett 16: 3932-6 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.030 BindingDB Entry DOI: 10.7270/Q2RJ4J3F |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50188015
(1-[Bis(4-fluoro-phenyl)-methyl]-4-(6-methyl-benzo[...)Show SMILES Cc1cc2OCOc2cc1CN1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1 Show InChI InChI=1S/C26H26F2N2O2/c1-18-14-24-25(32-17-31-24)15-21(18)16-29-10-12-30(13-11-29)26(19-2-6-22(27)7-3-19)20-4-8-23(28)9-5-20/h2-9,14-15,26H,10-13,16-17H2,1H3 | UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.14E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mysore
Curated by ChEMBL
| Assay Description Inhibition of electric eel AchE |
Bioorg Med Chem Lett 16: 3932-6 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.030 BindingDB Entry DOI: 10.7270/Q2RJ4J3F |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50188018
(3-(2-{4-[bis(4-fluoro-phenyl)-methyl]-piperazine-1...)Show SMILES Cc1nc2CCCCc2c(O)c1CCN1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1 Show InChI InChI=1S/C29H33F2N3O/c1-20-25(29(35)26-4-2-3-5-27(26)32-20)14-15-33-16-18-34(19-17-33)28(21-6-10-23(30)11-7-21)22-8-12-24(31)13-9-22/h6-13,28H,2-5,14-19H2,1H3,(H,32,35) | UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 1.21E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mysore
Curated by ChEMBL
| Assay Description Inhibition of electric eel AchE |
Bioorg Med Chem Lett 16: 3932-6 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.030 BindingDB Entry DOI: 10.7270/Q2RJ4J3F |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50188015
(1-[Bis(4-fluoro-phenyl)-methyl]-4-(6-methyl-benzo[...)Show SMILES Cc1cc2OCOc2cc1CN1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1 Show InChI InChI=1S/C26H26F2N2O2/c1-18-14-24-25(32-17-31-24)15-21(18)16-29-10-12-30(13-11-29)26(19-2-6-22(27)7-3-19)20-4-8-23(28)9-5-20/h2-9,14-15,26H,10-13,16-17H2,1H3 | 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/a | n/a | 1.34E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mysore
Curated by ChEMBL
| Assay Description Inhibition of human serum AchE |
Bioorg Med Chem Lett 16: 3932-6 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.030 BindingDB Entry DOI: 10.7270/Q2RJ4J3F |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50188017
(3-(2-{4-[bis(4-fluoro-phenyl)-methyl]piperazine-1-...)Show SMILES Cc1nc2ccccn2c(=O)c1CCN1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1 Show InChI InChI=1S/C28H28F2N4O/c1-20-25(28(35)34-14-3-2-4-26(34)31-20)13-15-32-16-18-33(19-17-32)27(21-5-9-23(29)10-6-21)22-7-11-24(30)12-8-22/h2-12,14,27H,13,15-19H2,1H3 | UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 2.13E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mysore
Curated by ChEMBL
| Assay Description Inhibition of electric eel AchE |
Bioorg Med Chem Lett 16: 3932-6 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.030 BindingDB Entry DOI: 10.7270/Q2RJ4J3F |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50188017
(3-(2-{4-[bis(4-fluoro-phenyl)-methyl]piperazine-1-...)Show SMILES Cc1nc2ccccn2c(=O)c1CCN1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1 Show InChI InChI=1S/C28H28F2N4O/c1-20-25(28(35)34-14-3-2-4-26(34)31-20)13-15-32-16-18-33(19-17-32)27(21-5-9-23(29)10-6-21)22-7-11-24(30)12-8-22/h2-12,14,27H,13,15-19H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 3.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mysore
Curated by ChEMBL
| Assay Description Inhibition of human serum AchE |
Bioorg Med Chem Lett 16: 3932-6 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.030 BindingDB Entry DOI: 10.7270/Q2RJ4J3F |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50022775
((m-Hydroxyphenyl)trimethylammonium dimethylcarbama...)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/a | n/a | 4.11E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mysore
Curated by ChEMBL
| Assay Description Inhibition of electric eel AchE |
Bioorg Med Chem Lett 16: 3932-6 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.030 BindingDB Entry DOI: 10.7270/Q2RJ4J3F |
More data for this Ligand-Target Pair | |