Found 60 hits with Last Name = 'de brito' and Initial = 'ma' 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
(Homo sapiens (Human)) | BDBM50032162
(3-[2-(1-Benzyl-piperidin-4-yl)-ethyl]-5,7-dihydro-...)Show SMILES O=C1Cc2cc3c(CCC4CCN(Cc5ccccc5)CC4)noc3cc2N1 Show InChI InChI=1S/C23H25N3O2/c27-23-13-18-12-19-20(25-28-22(19)14-21(18)24-23)7-6-16-8-10-26(11-9-16)15-17-4-2-1-3-5-17/h1-5,12,14,16H,6-11,13,15H2,(H,24,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL MCE PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 0.331 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50032161
(3-[2-(1-Benzyl-piperidin-4-yl)-ethyl]-7-methyl-5,7...)Show SMILES CN1C(=O)Cc2cc3c(CCC4CCN(Cc5ccccc5)CC4)noc3cc12 Show InChI InChI=1S/C24H27N3O2/c1-26-22-15-23-20(13-19(22)14-24(26)28)21(25-29-23)8-7-17-9-11-27(12-10-17)16-18-5-3-2-4-6-18/h2-6,13,15,17H,7-12,14,16H2,1H3 | 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 | 0.479 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50417809
(CHEMBL1651249)Show SMILES Oc1ccc(CN2CCC(CCC(=O)c3cc4CCC(=O)n5ccc(c3)c45)CC2)cc1 Show InChI InChI=1S/C26H28N2O3/c29-23-5-1-19(2-6-23)17-27-12-9-18(10-13-27)3-7-24(30)22-15-20-4-8-25(31)28-14-11-21(16-22)26(20)28/h1-2,5-6,11,14-16,18,29H,3-4,7-10,12-13,17H2 | 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 | 0.490 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50032164
(3-(2-(1-benzylpiperidin-4-yl)ethyl)-5,6-dihydroiso...)Show SMILES O=C1CCc2cc3c(CCC4CCN(Cc5ccccc5)CC4)noc3cc2N1 Show InChI InChI=1S/C24H27N3O2/c28-24-9-7-19-14-20-21(26-29-23(20)15-22(19)25-24)8-6-17-10-12-27(13-11-17)16-18-4-2-1-3-5-18/h1-5,14-15,17H,6-13,16H2,(H,25,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 0.575 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50417798
(CHEMBL1651247)Show SMILES C(Cc1noc2cc(ccc12)C1CCCCC1)C1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C27H34N2O/c1-3-7-22(8-4-1)20-29-17-15-21(16-18-29)11-14-26-25-13-12-24(19-27(25)30-28-26)23-9-5-2-6-10-23/h1,3-4,7-8,12-13,19,21,23H,2,5-6,9-11,14-18,20H2 | 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 | 0.794 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50032163
(3-(2-(1-benzylpiperidin-4-yl)ethyl)-5H-isoxazolo[5...)Show SMILES O=C1Cc2cc3onc(CCC4CCN(Cc5ccccc5)CC4)c3cc2N1 Show InChI InChI=1S/C23H25N3O2/c27-23-13-18-12-22-19(14-21(18)24-23)20(25-28-22)7-6-16-8-10-26(11-9-16)15-17-4-2-1-3-5-17/h1-5,12,14,16H,6-11,13,15H2,(H,24,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 0.955 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50417791
(CHEMBL1651139)Show SMILES Oc1ccccc1CN1CCC(CCC(=O)c2cc3CCC(=O)n4ccc(c2)c34)CC1 Show InChI InChI=1S/C26H28N2O3/c29-23-4-2-1-3-21(23)17-27-12-9-18(10-13-27)5-7-24(30)22-15-19-6-8-25(31)28-14-11-20(16-22)26(19)28/h1-4,11,14-16,18,29H,5-10,12-13,17H2 | 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 | 1.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50417787
(CHEMBL1651132)Show SMILES Fc1cccc(CN2CCC(CCC(=O)c3cc4CCC(=O)n5ccc(c3)c45)CC2)c1 Show InChI InChI=1S/C26H27FN2O2/c27-23-3-1-2-19(14-23)17-28-11-8-18(9-12-28)4-6-24(30)22-15-20-5-7-25(31)29-13-10-21(16-22)26(20)29/h1-3,10,13-16,18H,4-9,11-12,17H2 | 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 | 1.29 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50417786
(CHEMBL1651131)Show SMILES Fc1ccccc1CN1CCC(CCC(=O)c2cc3CCC(=O)n4ccc(c2)c34)CC1 Show InChI InChI=1S/C26H27FN2O2/c27-23-4-2-1-3-21(23)17-28-12-9-18(10-13-28)5-7-24(30)22-15-19-6-8-25(31)29-14-11-20(16-22)26(19)29/h1-4,11,14-16,18H,5-10,12-13,17H2 | 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 | 2.51 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50032165
(CHEMBL92736 | CHEMBL94217 | N-{3-[2-(1-Benzyl-pipe...)Show SMILES CC(=O)Nc1ccc2c(CCC3CCN(Cc4ccccc4)CC3)noc2c1 Show InChI InChI=1S/C23H27N3O2/c1-17(27)24-20-8-9-21-22(25-28-23(21)15-20)10-7-18-11-13-26(14-12-18)16-19-5-3-2-4-6-19/h2-6,8-9,15,18H,7,10-14,16H2,1H3,(H,24,27) | 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 | 2.82 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50417793
(CHEMBL1651243)Show SMILES [O-][N+](=O)c1cccc(CN2CCC(CCC(=O)c3cc4CCC(=O)n5ccc(c3)c45)CC2)c1 Show InChI InChI=1S/C26H27N3O4/c30-24(22-15-20-5-7-25(31)28-13-10-21(16-22)26(20)28)6-4-18-8-11-27(12-9-18)17-19-2-1-3-23(14-19)29(32)33/h1-3,10,13-16,18H,4-9,11-12,17H2 | 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 | 2.88 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50417785
(CHEMBL1651129)Show SMILES O=C(CCC1CCN(Cc2ccccc2)CC1)c1cc2CC(=O)N3CCCc(c1)c23 Show InChI InChI=1S/C26H30N2O2/c29-24(22-15-21-7-4-12-28-25(30)17-23(16-22)26(21)28)9-8-19-10-13-27(14-11-19)18-20-5-2-1-3-6-20/h1-3,5-6,15-16,19H,4,7-14,17-18H2 | 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 | 3.63 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50032160
(3-(2-(1-benzylpiperidin-4-yl)ethyl)-6H-isoxazolo[5...)Show SMILES O=C1Cc2c(N1)ccc1c(CCC3CCN(Cc4ccccc4)CC3)noc21 Show InChI InChI=1S/C23H25N3O2/c27-22-14-19-20(24-22)9-7-18-21(25-28-23(18)19)8-6-16-10-12-26(13-11-16)15-17-4-2-1-3-5-17/h1-5,7,9,16H,6,8,10-15H2,(H,24,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 3.63 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50034001
(3-(1-Benzyl-piperidin-4-yl)-1-(1-ethyl-2-methyl-1H...)Show SMILES CCn1c(C)nc2cc(ccc12)C(=O)CCC1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C25H31N3O/c1-3-28-19(2)26-23-17-22(10-11-24(23)28)25(29)12-9-20-13-15-27(16-14-20)18-21-7-5-4-6-8-21/h4-8,10-11,17,20H,3,9,12-16,18H2,1-2H3 | 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 | 4.27 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50417799
(CHEMBL1651248)Show SMILES Fc1ccc(CN2CCC(CCC(=O)c3cc4CCC(=O)n5ccc(c3)c45)CC2)cc1 Show InChI InChI=1S/C26H27FN2O2/c27-23-5-1-19(2-6-23)17-28-12-9-18(10-13-28)3-7-24(30)22-15-20-4-8-25(31)29-14-11-21(16-22)26(20)29/h1-2,5-6,11,14-16,18H,3-4,7-10,12-13,17H2 | 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 | 4.57 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50417788
(CHEMBL1651134)Show SMILES Clc1cccc(CN2CCC(CCC(=O)c3cc4CCC(=O)n5ccc(c3)c45)CC2)c1 Show InChI InChI=1S/C26H27ClN2O2/c27-23-3-1-2-19(14-23)17-28-11-8-18(9-12-28)4-6-24(30)22-15-20-5-7-25(31)29-13-10-21(16-22)26(20)29/h1-3,10,13-16,18H,4-9,11-12,17H2 | 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 | 4.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50417803
(CHEMBL1651133)Show SMILES Clc1ccccc1CN1CCC(CCC(=O)c2cc3CCC(=O)n4ccc(c2)c34)CC1 Show InChI InChI=1S/C26H27ClN2O2/c27-23-4-2-1-3-21(23)17-28-12-9-18(10-13-28)5-7-24(30)22-15-19-6-8-25(31)29-14-11-20(16-22)26(19)29/h1-4,11,14-16,18H,5-10,12-13,17H2 | 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 | 5.13 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50039729
(3-(2-(1-benzylpiperidin-4-yl)ethyl)-5,6-dimethylbe...)Show InChI InChI=1S/C23H28N2O/c1-17-14-21-22(24-26-23(21)15-18(17)2)9-8-19-10-12-25(13-11-19)16-20-6-4-3-5-7-20/h3-7,14-15,19H,8-13,16H2,1-2H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 5.75 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50034002
(3-(1-Benzyl-piperidin-4-yl)-1-(2-methyl-benzothiaz...)Show InChI InChI=1S/C23H26N2OS/c1-17-24-21-9-8-20(15-23(21)27-17)22(26)10-7-18-11-13-25(14-12-18)16-19-5-3-2-4-6-19/h2-6,8-9,15,18H,7,10-14,16H2,1H3 | 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 | 6.76 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50039713
(3-(2-(1-benzylpiperidin-4-yl)ethyl)-7-methoxybenzo...)Show InChI InChI=1S/C22H26N2O2/c1-25-21-9-5-8-19-20(23-26-22(19)21)11-10-17-12-14-24(15-13-17)16-18-6-3-2-4-7-18/h2-9,17H,10-16H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 7.08 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50039712
(3-(2-(1-benzylpiperidin-4-yl)ethyl)-5-methoxybenzo...)Show InChI InChI=1S/C22H26N2O2/c1-25-19-8-10-22-20(15-19)21(23-26-22)9-7-17-11-13-24(14-12-17)16-18-5-3-2-4-6-18/h2-6,8,10,15,17H,7,9,11-14,16H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 7.24 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50039728
(3-(2-(1-benzylpiperidin-4-yl)ethyl)-5-methylbenzo[...)Show InChI InChI=1S/C22H26N2O/c1-17-7-10-22-20(15-17)21(23-25-22)9-8-18-11-13-24(14-12-18)16-19-5-3-2-4-6-19/h2-7,10,15,18H,8-9,11-14,16H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 7.76 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50039717
(3-(2-(1-benzylpiperidin-4-yl)ethyl)-6-methoxybenzo...)Show InChI InChI=1S/C22H26N2O2/c1-25-19-8-9-20-21(23-26-22(20)15-19)10-7-17-11-13-24(14-12-17)16-18-5-3-2-4-6-18/h2-6,8-9,15,17H,7,10-14,16H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 8.32 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50039723
(3-(2-(1-benzylpiperidin-4-yl)ethyl)benzo[d]isoxazo...)Show InChI InChI=1S/C22H25N3O2/c23-22(26)18-7-8-19-20(24-27-21(19)14-18)9-6-16-10-12-25(13-11-16)15-17-4-2-1-3-5-17/h1-5,7-8,14,16H,6,9-13,15H2,(H2,23,26) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 8.71 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50417792
(CHEMBL1651140)Show SMILES Oc1cccc(CN2CCC(CCC(=O)c3cc4CCC(=O)n5ccc(c3)c45)CC2)c1 Show InChI InChI=1S/C26H28N2O3/c29-23-3-1-2-19(14-23)17-27-11-8-18(9-12-27)4-6-24(30)22-15-20-5-7-25(31)28-13-10-21(16-22)26(20)28/h1-3,10,13-16,18,29H,4-9,11-12,17H2 | 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 | 8.71 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50039727
(CHEMBL93123 | N-(3-(2-(1-benzylpiperidin-4-yl)ethy...)Show SMILES O=C(Nc1ccc2c(CCC3CCN(Cc4ccccc4)CC3)noc2c1)c1ccccc1 Show InChI InChI=1S/C28H29N3O2/c32-28(23-9-5-2-6-10-23)29-24-12-13-25-26(30-33-27(25)19-24)14-11-21-15-17-31(18-16-21)20-22-7-3-1-4-8-22/h1-10,12-13,19,21H,11,14-18,20H2,(H,29,32) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 9.33 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50417802
(CHEMBL1651130)Show SMILES O=C(CCC1CCN(Cc2ccccc2)CC1)c1cc2CCN3c2c(CCC3=O)c1 Show InChI InChI=1S/C26H30N2O2/c29-24(23-16-21-7-9-25(30)28-15-12-22(17-23)26(21)28)8-6-19-10-13-27(14-11-19)18-20-4-2-1-3-5-20/h1-5,16-17,19H,6-15,18H2 | 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 | 9.77 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50034003
(3-(1-Benzyl-piperidin-4-yl)-1-(2-methyl-1H-benzoim...)Show SMILES Cc1nc2ccc(cc2[nH]1)C(=O)CCC1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C23H27N3O/c1-17-24-21-9-8-20(15-22(21)25-17)23(27)10-7-18-11-13-26(14-12-18)16-19-5-3-2-4-6-19/h2-6,8-9,15,18H,7,10-14,16H2,1H3,(H,24,25) | 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 | 12.0 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50417808
(CHEMBL1651246)Show SMILES CS(=O)(=O)Nc1ccc2c(CCC3CCN(Cc4ccccc4)CC3)noc2c1 Show InChI InChI=1S/C22H27N3O3S/c1-29(26,27)24-19-8-9-20-21(23-28-22(20)15-19)10-7-17-11-13-25(14-12-17)16-18-5-3-2-4-6-18/h2-6,8-9,15,17,24H,7,10-14,16H2,1H3 | 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 | 14.1 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50417794
(CHEMBL1651244)Show SMILES O=C(CCC1CCN(Cc2ccccc2)CC1)c1cc2CCCN3C(=O)CCc(c1)c23 Show InChI InChI=1S/C27H32N2O2/c30-25(10-8-20-12-15-28(16-13-20)19-21-5-2-1-3-6-21)24-17-22-7-4-14-29-26(31)11-9-23(18-24)27(22)29/h1-3,5-6,17-18,20H,4,7-16,19H2 | 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 | 15.8 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50039719
(3-(2-(1-benzylpiperidin-4-yl)ethyl)benzo[d]isoxazo...)Show InChI InChI=1S/C21H25N3O/c22-18-7-8-19-20(23-25-21(19)14-18)9-6-16-10-12-24(13-11-16)15-17-4-2-1-3-5-17/h1-5,7-8,14,16H,6,9-13,15,22H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 19.9 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50417783
(CHEMBL1651126)Show InChI InChI=1S/C25H32N2O/c28-25(23-10-9-22-7-4-14-26-18-24(22)17-23)11-8-20-12-15-27(16-13-20)19-21-5-2-1-3-6-21/h1-3,5-6,9-10,17,20,26H,4,7-8,11-16,18-19H2 | 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 | 22.9 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50417801
(CHEMBL1651127)Show InChI InChI=1S/C25H32N2O/c28-25(24-8-7-22-10-14-26-15-11-23(22)18-24)9-6-20-12-16-27(17-13-20)19-21-4-2-1-3-5-21/h1-5,7-8,18,20,26H,6,9-17,19H2 | 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 | 25.1 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50039731
(3-(2-(1-benzylpiperidin-4-yl)ethyl)benzo[d]isoxazo...)Show InChI InChI=1S/C21H24N2O2/c24-18-7-8-19-20(22-25-21(19)14-18)9-6-16-10-12-23(13-11-16)15-17-4-2-1-3-5-17/h1-5,7-8,14,16,24H,6,9-13,15H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 25.7 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50034000
(3-(1-Benzyl-piperidin-4-yl)-1-(2,3-dihydro-benzo[1...)Show InChI InChI=1S/C23H27NO3/c25-21(20-7-9-22-23(16-20)27-15-14-26-22)8-6-18-10-12-24(13-11-18)17-19-4-2-1-3-5-19/h1-5,7,9,16,18H,6,8,10-15,17H2 | 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 | 30.2 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50417796
(CHEMBL1651125)Show SMILES O=C(CCC1CCN(Cc2ccccc2)CC1)c1ccc2NC(Nc2c1)c1ccccc1 Show InChI InChI=1S/C28H31N3O/c32-27(14-11-21-15-17-31(18-16-21)20-22-7-3-1-4-8-22)24-12-13-25-26(19-24)30-28(29-25)23-9-5-2-6-10-23/h1-10,12-13,19,21,28-30H,11,14-18,20H2 | 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 | 33.1 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50417784
(CHEMBL1651128)Show InChI InChI=1S/C24H30N2O2/c27-23(21-7-9-24-22(16-21)17-25-12-15-28-24)8-6-19-10-13-26(14-11-19)18-20-4-2-1-3-5-20/h1-5,7,9,16,19,25H,6,8,10-15,17-18H2 | 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 | 39.8 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50417800
(CHEMBL1651250)Show SMILES [O-][N+](=O)c1ccc(CN2CCC(CCC(=O)c3cc4CCC(=O)n5ccc(c3)c45)CC2)cc1 Show InChI InChI=1S/C26H27N3O4/c30-24(22-15-20-4-8-25(31)28-14-11-21(16-22)26(20)28)7-3-18-9-12-27(13-10-18)17-19-1-5-23(6-2-19)29(32)33/h1-2,5-6,11,14-16,18H,3-4,7-10,12-13,17H2 | 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 | 42.7 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50039734
(3-(2-(1-benzylpiperidin-4-yl)ethyl)-6-bromobenzo[d...)Show InChI InChI=1S/C21H23BrN2O/c22-18-7-8-19-20(23-25-21(19)14-18)9-6-16-10-12-24(13-11-16)15-17-4-2-1-3-5-17/h1-5,7-8,14,16H,6,9-13,15H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 50.1 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50417807
(CHEMBL1651245)Show SMILES O=C(CCC1CCN(Cc2ccccc2)CC1)c1cc2CCN3c2c(CCCC3=O)c1 Show InChI InChI=1S/C27H32N2O2/c30-25(10-9-20-11-14-28(15-12-20)19-21-5-2-1-3-6-21)24-17-22-7-4-8-26(31)29-16-13-23(18-24)27(22)29/h1-3,5-6,17-18,20H,4,7-16,19H2 | 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 | 52.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50037138
(3-(1-Benzyl-piperidin-4-yl)-1-(2,3-dihydro-1H-indo...)Show InChI InChI=1S/C23H28N2O/c26-23(21-7-8-22-20(16-21)10-13-24-22)9-6-18-11-14-25(15-12-18)17-19-4-2-1-3-5-19/h1-5,7-8,16,18,24H,6,9-15,17H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 52.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50039716
(3-(2-(1-benzylpiperidin-4-yl)ethyl)benzo[d]isoxazo...)Show InChI InChI=1S/C21H24N2O/c1-2-6-18(7-3-1)16-23-14-12-17(13-15-23)10-11-20-19-8-4-5-9-21(19)24-22-20/h1-9,17H,10-16H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 55.0 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50417789
(CHEMBL1651136)Show SMILES COc1ccccc1CN1CCC(CCC(=O)c2cc3CCC(=O)n4ccc(c2)c34)CC1 Show InChI InChI=1S/C27H30N2O3/c1-32-25-5-3-2-4-22(25)18-28-13-10-19(11-14-28)6-8-24(30)23-16-20-7-9-26(31)29-15-12-21(17-23)27(20)29/h2-5,12,15-17,19H,6-11,13-14,18H2,1H3 | 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 | 64.6 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50318853
(3-(1-benzylpiperidin-4-yl)-1-(1,2,3,4-tetrahydroqu...)Show InChI InChI=1S/C24H30N2O/c27-24(22-9-10-23-21(17-22)7-4-14-25-23)11-8-19-12-15-26(16-13-19)18-20-5-2-1-3-6-20/h1-3,5-6,9-10,17,19,25H,4,7-8,11-16,18H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 64.6 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50417806
(CHEMBL1651141)Show SMILES [O-][N+](=O)c1ccccc1CN1CCC(CCC(=O)c2cc3CCC(=O)n4ccc(c2)c34)CC1 Show InChI InChI=1S/C26H27N3O4/c30-24(22-15-19-6-8-25(31)28-14-11-20(16-22)26(19)28)7-5-18-9-12-27(13-10-18)17-21-3-1-2-4-23(21)29(32)33/h1-4,11,14-16,18H,5-10,12-13,17H2 | 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 | 89.1 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50039715
(3-[2-(1-Benzyl-piperidin-4-yl)-ethyl]-benzo[d]isot...)Show InChI InChI=1S/C21H24N2S/c1-2-6-18(7-3-1)16-23-14-12-17(13-15-23)10-11-20-19-8-4-5-9-21(19)24-22-20/h1-9,17H,10-16H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
| Article PubMed
| n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50039720
(3-[2-(1-Benzyl-piperidin-4-yl)-ethyl]-1H-indazole ...)Show InChI InChI=1S/C21H25N3/c1-2-6-18(7-3-1)16-24-14-12-17(13-15-24)10-11-21-19-8-4-5-9-20(19)22-23-21/h1-9,17H,10-16H2,(H,22,23) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 120 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50417790
(CHEMBL1651137)Show SMILES COc1cccc(CN2CCC(CCC(=O)c3cc4CCC(=O)n5ccc(c3)c45)CC2)c1 Show InChI InChI=1S/C27H30N2O3/c1-32-24-4-2-3-20(15-24)18-28-12-9-19(10-13-28)5-7-25(30)23-16-21-6-8-26(31)29-14-11-22(17-23)27(21)29/h2-4,11,14-17,19H,5-10,12-13,18H2,1H3 | 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 | 126 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50417804
(CHEMBL1651135)Show SMILES Clc1ccc(CN2CCC(CCC(=O)c3cc4CCC(=O)n5ccc(c3)c45)CC2)cc1 Show InChI InChI=1S/C26H27ClN2O2/c27-23-5-1-19(2-6-23)17-28-12-9-18(10-13-28)3-7-24(30)22-15-20-4-8-25(31)29-14-11-21(16-22)26(20)29/h1-2,5-6,11,14-16,18H,3-4,7-10,12-13,17H2 | 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 | 151 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |
Acetylcholinesterase
(Homo sapiens (Human)) | BDBM50039206
(3-(1-Benzyl-piperidin-4-yl)-1-(1,2,3,4-tetrahydro-...)Show InChI InChI=1S/C24H30N2O/c27-24(22-10-9-21-7-4-14-25-23(21)17-22)11-8-19-12-15-26(16-13-19)18-20-5-2-1-3-6-20/h1-3,5-6,9-10,17,19,25H,4,7-8,11-16,18H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 166 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal do Rio de Janeiro (UFRJ)
Curated by ChEMBL
| Assay Description Inhibition of human acetylcholinesterase |
Eur J Med Chem 46: 39-51 (2010)
Article DOI: 10.1016/j.ejmech.2010.10.009 BindingDB Entry DOI: 10.7270/Q2SX6FG0 |
More data for this Ligand-Target Pair | |