Found 36 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)) | BDBM50211239
(1-methyl-1-[2-(7-oxo-7H-1-aza-benzo[de]anthracen-9...)Show SMILES C[N+]1(CCC(=O)Nc2ccc-3c(c2)C(=O)c2cccc4ccnc-3c24)CCCC1 Show InChI InChI=1S/C24H23N3O2/c1-27(12-2-3-13-27)14-10-21(28)26-17-7-8-18-20(15-17)24(29)19-6-4-5-16-9-11-25-23(18)22(16)19/h4-9,11,15H,2-3,10,12-14H2,1H3/p+1 | UniProtKB/SwissProt
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.06 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of electric eel AChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50211252
(1-methyl-1-[(7-oxo-7H-1-aza-benzo[de]anthracen-9-y...)Show SMILES C[N+]1(CC(=O)Nc2ccc-3c(c2)C(=O)c2cccc4ccnc-3c24)CCCC1 Show InChI InChI=1S/C23H21N3O2/c1-26(11-2-3-12-26)14-20(27)25-16-7-8-17-19(13-16)23(28)18-6-4-5-15-9-10-24-22(17)21(15)18/h4-10,13H,2-3,11-12,14H2,1H3/p+1 | UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.08 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of electric eel AChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50211241
(9-[3-Pyrrolidinopropionamido]-1-azabenzanthrone | ...)Show SMILES O=C(CCN1CCCC1)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C23H21N3O2/c27-20(9-13-26-11-1-2-12-26)25-16-6-7-17-19(14-16)23(28)18-5-3-4-15-8-10-24-22(17)21(15)18/h3-8,10,14H,1-2,9,11-13H2,(H,25,27) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.47 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of electric eel AChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50211250
(1-methyl-1-[3-(7-oxo-7H-1-aza-benzo[de]anthracen-9...)Show SMILES C[N+]1(CCCC(=O)Nc2ccc-3c(c2)C(=O)c2cccc4ccnc-3c24)CCCC1 Show InChI InChI=1S/C25H25N3O2/c1-28(13-2-3-14-28)15-5-8-22(29)27-18-9-10-19-21(16-18)25(30)20-7-4-6-17-11-12-26-24(19)23(17)20/h4,6-7,9-12,16H,2-3,5,8,13-15H2,1H3/p+1 | UniProtKB/SwissProt
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 |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of electric eel AChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50371216
(CHEMBL554252)Show SMILES CC[N+](C)(CC)CCCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C25H27N3O2/c1-4-28(3,5-2)15-7-10-22(29)27-18-11-12-19-21(16-18)25(30)20-9-6-8-17-13-14-26-24(19)23(17)20/h6,8-9,11-14,16H,4-5,7,10,15H2,1-3H3/p+1 | UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.62 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of electric eel AChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50211253
(CHEMBL245668 | trimethyl-[3-(7-oxo-7H-1-aza-benzo[...)Show SMILES C[N+](C)(C)CCCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C23H23N3O2/c1-26(2,3)13-5-8-20(27)25-16-9-10-17-19(14-16)23(28)18-7-4-6-15-11-12-24-22(17)21(15)18/h4,6-7,9-12,14H,5,8,13H2,1-3H3/p+1 | UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.79 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of electric eel AChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50211244
(CHEMBL395926 | Trimethyl-[2-(7-oxo-7H-1-aza-benzo[...)Show SMILES C[N+](C)(C)CCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C22H21N3O2/c1-25(2,3)12-10-19(26)24-15-7-8-16-18(13-15)22(27)17-6-4-5-14-9-11-23-21(16)20(14)17/h4-9,11,13H,10,12H2,1-3H3/p+1 | UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.81 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of electric eel AChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50211254
(9-(Pyrrolidinoacetamido)-1-azabenzanthrone | CHEMB...)Show SMILES O=C(CN1CCCC1)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C22H19N3O2/c26-19(13-25-10-1-2-11-25)24-15-6-7-16-18(12-15)22(27)17-5-3-4-14-8-9-23-21(16)20(14)17/h3-9,12H,1-2,10-11,13H2,(H,24,26) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.18 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of electric eel AChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50211251
(3-diethylamino-N-(7-oxo-7H-1-aza-benzo[de]anthrace...)Show SMILES CCN(CC)CCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C23H23N3O2/c1-3-26(4-2)13-11-20(27)25-16-8-9-17-19(14-16)23(28)18-7-5-6-15-10-12-24-22(17)21(15)18/h5-10,12,14H,3-4,11,13H2,1-2H3,(H,25,27) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 11.6 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of electric eel AChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50211238
(9-(4-Pyrrolidinobutyramido)-1-azabenzanthrone | CH...)Show SMILES O=C(CCCN1CCCC1)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C24H23N3O2/c28-21(7-4-14-27-12-1-2-13-27)26-17-8-9-18-20(15-17)24(29)19-6-3-5-16-10-11-25-23(18)22(16)19/h3,5-6,8-11,15H,1-2,4,7,12-14H2,(H,26,28) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 12.1 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of electric eel AChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50211248
(CHEMBL428575 | trimethyl-[(7-oxo-7H-1-aza-benzo[de...)Show SMILES C[N+](C)(C)CC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C21H19N3O2/c1-24(2,3)12-18(25)23-14-7-8-15-17(11-14)21(26)16-6-4-5-13-9-10-22-20(15)19(13)16/h4-11H,12H2,1-3H3/p+1 | UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 14.9 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of electric eel AChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50211242
(4-dimethylamino-N-(7-oxo-7H-1-aza-benzo[de]anthrac...)Show SMILES CN(C)CCCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C22H21N3O2/c1-25(2)12-4-7-19(26)24-15-8-9-16-18(13-15)22(27)17-6-3-5-14-10-11-23-21(16)20(14)17/h3,5-6,8-11,13H,4,7,12H2,1-2H3,(H,24,26) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 30.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of electric eel AChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50211243
(3-dimethylamino-N-(7-oxo-7H-1-aza-benzo[de]anthrac...)Show SMILES CN(C)CCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C21H19N3O2/c1-24(2)11-9-18(25)23-14-6-7-15-17(12-14)21(26)16-5-3-4-13-8-10-22-20(15)19(13)16/h3-8,10,12H,9,11H2,1-2H3,(H,23,25) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 33.9 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of electric eel AChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50211245
(3-(2-hydroxy-ethylamino)-N-(7-oxo-7H-1-aza-benzo[d...)Show SMILES OCCNCCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C21H19N3O3/c25-11-10-22-8-7-18(26)24-14-4-5-15-17(12-14)21(27)16-3-1-2-13-6-9-23-20(15)19(13)16/h1-6,9,12,22,25H,7-8,10-11H2,(H,24,26) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 55.1 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of electric eel AChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50211246
(2-dimethylamino-N-(7-oxo-7H-1-aza-benzo[de]anthrac...)Show SMILES CN(C)CC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C20H17N3O2/c1-23(2)11-17(24)22-13-6-7-14-16(10-13)20(25)15-5-3-4-12-8-9-21-19(14)18(12)15/h3-10H,11H2,1-2H3,(H,22,24) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 96.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of electric eel AChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50211249
(3-(2-dimethylamino-ethylamino)-N-(7-oxo-7H-1-aza-b...)Show SMILES CN(C)CCNCCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C23H24N4O2/c1-27(2)13-12-24-10-9-20(28)26-16-6-7-17-19(14-16)23(29)18-5-3-4-15-8-11-25-22(17)21(15)18/h3-8,11,14,24H,9-10,12-13H2,1-2H3,(H,26,28) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 120 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of electric eel AChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM10404
((1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetrac...)Show SMILES COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 |r,c:12| Show InChI InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 | UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 550 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of electric eel AChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Carboxylic ester hydrolase
(Equus caballus (Horse)) | BDBM50211248
(CHEMBL428575 | trimethyl-[(7-oxo-7H-1-aza-benzo[de...)Show SMILES C[N+](C)(C)CC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C21H19N3O2/c1-24(2,3)12-18(25)23-14-7-8-15-17(11-14)21(26)16-6-4-5-13-9-10-22-20(15)19(13)16/h4-11H,12H2,1-3H3/p+1 | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.31E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of equine serum BuChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Carboxylic ester hydrolase
(Equus caballus (Horse)) | BDBM50211252
(1-methyl-1-[(7-oxo-7H-1-aza-benzo[de]anthracen-9-y...)Show SMILES C[N+]1(CC(=O)Nc2ccc-3c(c2)C(=O)c2cccc4ccnc-3c24)CCCC1 Show InChI InChI=1S/C23H21N3O2/c1-26(11-2-3-12-26)14-20(27)25-16-7-8-17-19(13-16)23(28)18-6-4-5-15-9-10-24-22(17)21(15)18/h4-10,13H,2-3,11-12,14H2,1H3/p+1 | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.69E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of equine serum BuChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Carboxylic ester hydrolase
(Equus caballus (Horse)) | BDBM50211243
(3-dimethylamino-N-(7-oxo-7H-1-aza-benzo[de]anthrac...)Show SMILES CN(C)CCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C21H19N3O2/c1-24(2)11-9-18(25)23-14-6-7-15-17(12-14)21(26)16-5-3-4-13-8-10-22-20(15)19(13)16/h3-8,10,12H,9,11H2,1-2H3,(H,23,25) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.95E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of equine serum BuChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Carboxylic ester hydrolase
(Equus caballus (Horse)) | BDBM50211239
(1-methyl-1-[2-(7-oxo-7H-1-aza-benzo[de]anthracen-9...)Show SMILES C[N+]1(CCC(=O)Nc2ccc-3c(c2)C(=O)c2cccc4ccnc-3c24)CCCC1 Show InChI InChI=1S/C24H23N3O2/c1-27(12-2-3-13-27)14-10-21(28)26-17-7-8-18-20(15-17)24(29)19-6-4-5-16-9-11-25-23(18)22(16)19/h4-9,11,15H,2-3,10,12-14H2,1H3/p+1 | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.96E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of equine serum BuChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Carboxylic ester hydrolase
(Equus caballus (Horse)) | BDBM50211253
(CHEMBL245668 | trimethyl-[3-(7-oxo-7H-1-aza-benzo[...)Show SMILES C[N+](C)(C)CCCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C23H23N3O2/c1-26(2,3)13-5-8-20(27)25-16-9-10-17-19(14-16)23(28)18-7-4-6-15-11-12-24-22(17)21(15)18/h4,6-7,9-12,14H,5,8,13H2,1-3H3/p+1 | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.37E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of equine serum BuChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Carboxylic ester hydrolase
(Equus caballus (Horse)) | BDBM50211241
(9-[3-Pyrrolidinopropionamido]-1-azabenzanthrone | ...)Show SMILES O=C(CCN1CCCC1)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C23H21N3O2/c27-20(9-13-26-11-1-2-12-26)25-16-6-7-17-19(14-16)23(28)18-5-3-4-15-8-10-24-22(17)21(15)18/h3-8,10,14H,1-2,9,11-13H2,(H,25,27) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.41E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of equine serum BuChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Carboxylic ester hydrolase
(Equus caballus (Horse)) | BDBM50211244
(CHEMBL395926 | Trimethyl-[2-(7-oxo-7H-1-aza-benzo[...)Show SMILES C[N+](C)(C)CCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C22H21N3O2/c1-25(2,3)12-10-19(26)24-15-7-8-16-18(13-15)22(27)17-6-4-5-14-9-11-23-21(16)20(14)17/h4-9,11,13H,10,12H2,1-3H3/p+1 | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.82E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of equine serum BuChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Carboxylic ester hydrolase
(Equus caballus (Horse)) | BDBM50211250
(1-methyl-1-[3-(7-oxo-7H-1-aza-benzo[de]anthracen-9...)Show SMILES C[N+]1(CCCC(=O)Nc2ccc-3c(c2)C(=O)c2cccc4ccnc-3c24)CCCC1 Show InChI InChI=1S/C25H25N3O2/c1-28(13-2-3-14-28)15-5-8-22(29)27-18-9-10-19-21(16-18)25(30)20-7-4-6-17-11-12-26-24(19)23(17)20/h4,6-7,9-12,16H,2-3,5,8,13-15H2,1H3/p+1 | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.23E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of equine serum BuChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Carboxylic ester hydrolase
(Equus caballus (Horse)) | BDBM50211254
(9-(Pyrrolidinoacetamido)-1-azabenzanthrone | CHEMB...)Show SMILES O=C(CN1CCCC1)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C22H19N3O2/c26-19(13-25-10-1-2-11-25)24-15-6-7-16-18(12-15)22(27)17-5-3-4-14-8-9-23-21(16)20(14)17/h3-9,12H,1-2,10-11,13H2,(H,24,26) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.49E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of equine serum BuChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Carboxylic ester hydrolase
(Equus caballus (Horse)) | BDBM50211238
(9-(4-Pyrrolidinobutyramido)-1-azabenzanthrone | CH...)Show SMILES O=C(CCCN1CCCC1)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C24H23N3O2/c28-21(7-4-14-27-12-1-2-13-27)26-17-8-9-18-20(15-17)24(29)19-6-3-5-16-10-11-25-23(18)22(16)19/h3,5-6,8-11,15H,1-2,4,7,12-14H2,(H,26,28) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.61E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of equine serum BuChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Carboxylic ester hydrolase
(Equus caballus (Horse)) | BDBM50211246
(2-dimethylamino-N-(7-oxo-7H-1-aza-benzo[de]anthrac...)Show SMILES CN(C)CC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C20H17N3O2/c1-23(2)11-17(24)22-13-6-7-14-16(10-13)20(25)15-5-3-4-12-8-9-21-19(14)18(12)15/h3-10H,11H2,1-2H3,(H,22,24) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.37E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of equine serum BuChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Carboxylic ester hydrolase
(Equus caballus (Horse)) | BDBM50211242
(4-dimethylamino-N-(7-oxo-7H-1-aza-benzo[de]anthrac...)Show SMILES CN(C)CCCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C22H21N3O2/c1-25(2)12-4-7-19(26)24-15-8-9-16-18(13-15)22(27)17-6-3-5-14-10-11-23-21(16)20(14)17/h3,5-6,8-11,13H,4,7,12H2,1-2H3,(H,24,26) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of equine serum BuChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Carboxylic ester hydrolase
(Equus caballus (Horse)) | BDBM50371216
(CHEMBL554252)Show SMILES CC[N+](C)(CC)CCCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C25H27N3O2/c1-4-28(3,5-2)15-7-10-22(29)27-18-11-12-19-21(16-18)25(30)20-9-6-8-17-13-14-26-24(19)23(17)20/h6,8-9,11-14,16H,4-5,7,10,15H2,1-3H3/p+1 | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.19E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of equine serum BuChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Carboxylic ester hydrolase
(Equus caballus (Horse)) | BDBM50211245
(3-(2-hydroxy-ethylamino)-N-(7-oxo-7H-1-aza-benzo[d...)Show SMILES OCCNCCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C21H19N3O3/c25-11-10-22-8-7-18(26)24-14-4-5-15-17(12-14)21(27)16-3-1-2-13-6-9-23-20(15)19(13)16/h1-6,9,12,22,25H,7-8,10-11H2,(H,24,26) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.34E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of equine serum BuChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Carboxylic ester hydrolase
(Equus caballus (Horse)) | BDBM50211249
(3-(2-dimethylamino-ethylamino)-N-(7-oxo-7H-1-aza-b...)Show SMILES CN(C)CCNCCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C23H24N4O2/c1-27(2)13-12-24-10-9-20(28)26-16-6-7-17-19(14-16)23(29)18-5-3-4-15-8-11-25-22(17)21(15)18/h3-8,11,14,24H,9-10,12-13H2,1-2H3,(H,26,28) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.37E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of equine serum BuChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Carboxylic ester hydrolase
(Equus caballus (Horse)) | BDBM50211251
(3-diethylamino-N-(7-oxo-7H-1-aza-benzo[de]anthrace...)Show SMILES CCN(CC)CCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C23H23N3O2/c1-3-26(4-2)13-11-20(27)25-16-8-9-17-19(14-16)23(28)18-7-5-6-15-10-12-24-22(17)21(15)18/h5-10,12,14H,3-4,11,13H2,1-2H3,(H,25,27) | PDB
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UniProtKB/TrEMBL
B.MOAD
GoogleScholar
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.06E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of equine serum BuChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Carboxylic ester hydrolase
(Equus caballus (Horse)) | BDBM10404
((1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetrac...)Show SMILES COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 |r,c:12| Show InChI InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 | PDB
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Similars
| Article
PubMed
| n/a | n/a | 1.44E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of equine serum BuChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Acetylcholinesterase
(Electrophorus electricus (Electric eel)) | BDBM50211247
(9-Amino-1-azabenzanthrone | 9-amino-1-aza-benzo[de...)Show InChI InChI=1S/C16H10N2O/c17-10-4-5-11-13(8-10)16(19)12-3-1-2-9-6-7-18-15(11)14(9)12/h1-8H,17H2 | UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.69E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of electric eel AChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
Carboxylic ester hydrolase
(Equus caballus (Horse)) | BDBM50211247
(9-Amino-1-azabenzanthrone | 9-amino-1-aza-benzo[de...)Show InChI InChI=1S/C16H10N2O/c17-10-4-5-11-13(8-10)16(19)12-3-1-2-9-6-7-18-15(11)14(9)12/h1-8H,17H2 | PDB
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UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Sun Yat-Sen University
Curated by ChEMBL
| Assay Description
Inhibition of equine serum BuChE |
Bioorg Med Chem Lett 17: 3765-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.04.015
BindingDB Entry DOI: 10.7270/Q28C9X2C |
More data for this
Ligand-Target Pair | |
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