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PubMed code 18436348

Compile data set for download or QSAR
Found 68 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))
BDBM8960
PNG
((+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimet...)
Show SMILES COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC
Show InChI InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3
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n/an/a 12n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248715
PNG
((E)-2-{4-[(Diethylamino)methyl]benzylidene}-5,6-di...)
Show SMILES CCN(CC)Cc1ccc(\C=C2/Cc3cc(OC)c(OC)cc3C2=O)cc1
Show InChI InChI=1S/C23H27NO3/c1-5-24(6-2)15-17-9-7-16(8-10-17)11-19-12-18-13-21(26-3)22(27-4)14-20(18)23(19)25/h7-11,13-14H,5-6,12,15H2,1-4H3/b19-11+
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n/an/a 35n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248747
PNG
((E)-5,6-Dimethoxy-2-{4-[(pyrrolidin-1-yl)methyl]-b...)
Show SMILES COc1cc2C\C(=C/c3ccc(CN4CCCC4)cc3)C(=O)c2cc1OC
Show InChI InChI=1S/C23H25NO3/c1-26-21-13-18-12-19(23(25)20(18)14-22(21)27-2)11-16-5-7-17(8-6-16)15-24-9-3-4-10-24/h5-8,11,13-14H,3-4,9-10,12,15H2,1-2H3/b19-11+
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n/an/a 45n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248782
PNG
((Z)-5,6-Dimethoxy-2-{3-[(piperidin-1-yl)methyl]-be...)
Show SMILES COc1cc2O\C(=C/c3cccc(CN4CCCCC4)c3)C(=O)c2cc1OC
Show InChI InChI=1S/C23H25NO4/c1-26-20-13-18-19(14-21(20)27-2)28-22(23(18)25)12-16-7-6-8-17(11-16)15-24-9-4-3-5-10-24/h6-8,11-14H,3-5,9-10,15H2,1-2H3/b22-12-
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n/an/a 82n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248781
PNG
((E)-5,6-Dimethoxy-2-{4-[(piperidin-1-yl)methyl]-be...)
Show SMILES COc1cc2C\C(=C/c3ccc(CN4CCCCC4)cc3)C(=O)c2cc1OC
Show InChI InChI=1S/C24H27NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-6-8-18(9-7-17)16-25-10-4-3-5-11-25/h6-9,12,14-15H,3-5,10-11,13,16H2,1-2H3/b20-12+
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Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248880
PNG
(5,6-Dimethoxy-2-{4-[(piperidin-1-yl)methyl]-benzyl...)
Show SMILES COc1cc2CC(Cc3ccc(CN4CCCCC4)cc3)C(=O)c2cc1OC
Show InChI InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-6-8-18(9-7-17)16-25-10-4-3-5-11-25/h6-9,14-15,20H,3-5,10-13,16H2,1-2H3
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n/an/a 120n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248745
PNG
((Z)-2-{4-[(Diethylamino)methyl]benzylidene}-5,6-di...)
Show SMILES CCN(CC)Cc1ccc(\C=C2/Oc3cc(OC)c(OC)cc3C2=O)cc1
Show InChI InChI=1S/C22H25NO4/c1-5-23(6-2)14-16-9-7-15(8-10-16)11-21-22(24)17-12-19(25-3)20(26-4)13-18(17)27-21/h7-13H,5-6,14H2,1-4H3/b21-11-
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Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248849
PNG
(5,6-Dimethoxy-2-{4-[(pyrrolidin-1-yl)methyl]-benzy...)
Show SMILES COc1cc2CC(Cc3ccc(CN4CCCC4)cc3)C(=O)c2cc1OC
Show InChI InChI=1S/C23H27NO3/c1-26-21-13-18-12-19(23(25)20(18)14-22(21)27-2)11-16-5-7-17(8-6-16)15-24-9-3-4-10-24/h5-8,13-14,19H,3-4,9-12,15H2,1-2H3
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Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248780
PNG
((E)-5,6-Dimethoxy-2-{3-[(piperidin-1-yl)methyl]-be...)
Show SMILES COc1cc2C\C(=C/c3cccc(CN4CCCCC4)c3)C(=O)c2cc1OC
Show InChI InChI=1S/C24H27NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-7-6-8-18(11-17)16-25-9-4-3-5-10-25/h6-8,11-12,14-15H,3-5,9-10,13,16H2,1-2H3/b20-12+
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n/an/a 160n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248749
PNG
((Z)-5,6-Dimethoxy-2-{4-[(pyrrolidin-1-yl)methyl]-b...)
Show SMILES COc1cc2O\C(=C/c3ccc(CN4CCCC4)cc3)C(=O)c2cc1OC
Show InChI InChI=1S/C22H23NO4/c1-25-19-12-17-18(13-20(19)26-2)27-21(22(17)24)11-15-5-7-16(8-6-15)14-23-9-3-4-10-23/h5-8,11-13H,3-4,9-10,14H2,1-2H3/b21-11-
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n/an/a 160n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248746
PNG
((E)-5,6-Dimethoxy-2-{3-[(pyrrolidin-1-yl)methyl]-b...)
Show SMILES COc1cc2C\C(=C/c3cccc(CN4CCCC4)c3)C(=O)c2cc1OC
Show InChI InChI=1S/C23H25NO3/c1-26-21-13-18-12-19(23(25)20(18)14-22(21)27-2)11-16-6-5-7-17(10-16)15-24-8-3-4-9-24/h5-7,10-11,13-14H,3-4,8-9,12,15H2,1-2H3/b19-11+
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n/an/a 240n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248881
PNG
(5,6-Dimethoxy-2-{3-[(piperidin-1-yl)methyl]-benzyl...)
Show SMILES COc1cc2oc(Cc3cccc(CN4CCCCC4)c3)c(O)c2cc1OC
Show InChI InChI=1S/C23H27NO4/c1-26-20-13-18-19(14-21(20)27-2)28-22(23(18)25)12-16-7-6-8-17(11-16)15-24-9-4-3-5-10-24/h6-8,11,13-14,25H,3-5,9-10,12,15H2,1-2H3
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n/an/a 240n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248712
PNG
((E)-2-{4-[(Ethylmethylamino)methyl]benzylidene}-5,...)
Show SMILES CCN(C)Cc1ccc(\C=C2/Cc3cc(OC)c(OC)cc3C2=O)cc1
Show InChI InChI=1S/C22H25NO3/c1-5-23(2)14-16-8-6-15(7-9-16)10-18-11-17-12-20(25-3)21(26-4)13-19(17)22(18)24/h6-10,12-13H,5,11,14H2,1-4H3/b18-10+
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n/an/a 270n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248748
PNG
((Z)-5,6-Dimethoxy-2-{3-[(pyrrolidin-1-yl)methyl]-b...)
Show SMILES COc1cc2O\C(=C/c3cccc(CN4CCCC4)c3)C(=O)c2cc1OC
Show InChI InChI=1S/C22H23NO4/c1-25-19-12-17-18(13-20(19)26-2)27-21(22(17)24)11-15-6-5-7-16(10-15)14-23-8-3-4-9-23/h5-7,10-13H,3-4,8-9,14H2,1-2H3/b21-11-
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n/an/a 290n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248819
PNG
(2-{4-[(Diethylamino)methyl]benzyl}-5,6-dimethoxy2,...)
Show SMILES CCN(CC)Cc1ccc(CC2Cc3cc(OC)c(OC)cc3C2=O)cc1
Show InChI InChI=1S/C23H29NO3/c1-5-24(6-2)15-17-9-7-16(8-10-17)11-19-12-18-13-21(26-3)22(27-4)14-20(18)23(19)25/h7-10,13-14,19H,5-6,11-12,15H2,1-4H3
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Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248816
PNG
(2-{4-[(Ethylmethylamino)methyl]benzyl}-5,6-dimetho...)
Show SMILES CCN(C)Cc1ccc(CC2Cc3cc(OC)c(OC)cc3C2=O)cc1
Show InChI InChI=1S/C22H27NO3/c1-5-23(2)14-16-8-6-15(7-9-16)10-18-11-17-12-20(25-3)21(26-4)13-19(17)22(18)24/h6-9,12-13,18H,5,10-11,14H2,1-4H3
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Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248637
PNG
((E)-2-{4-[(Dimethylamino)methyl]benzylidene}-5,6-d...)
Show SMILES COc1cc2C\C(=C/c3ccc(CN(C)C)cc3)C(=O)c2cc1OC
Show InChI InChI=1S/C21H23NO3/c1-22(2)13-15-7-5-14(6-8-15)9-17-10-16-11-19(24-3)20(25-4)12-18(16)21(17)23/h5-9,11-12H,10,13H2,1-4H3/b17-9+
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n/an/a 420n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248714
PNG
((E)-2-{3-[(Diethylamino)methyl]benzylidene}-5,6-di...)
Show SMILES CCN(CC)Cc1cccc(\C=C2/Cc3cc(OC)c(OC)cc3C2=O)c1
Show InChI InChI=1S/C23H27NO3/c1-5-24(6-2)15-17-9-7-8-16(10-17)11-19-12-18-13-21(26-3)22(27-4)14-20(18)23(19)25/h7-11,13-14H,5-6,12,15H2,1-4H3/b19-11+
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n/an/a 440n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248847
PNG
(2-{4-[(Diethylamino)methyl]benzyl}-5,6-dimethoxybe...)
Show SMILES CCN(CC)Cc1ccc(Cc2oc3cc(OC)c(OC)cc3c2O)cc1
Show InChI InChI=1S/C22H27NO4/c1-5-23(6-2)14-16-9-7-15(8-10-16)11-21-22(24)17-12-19(25-3)20(26-4)13-18(17)27-21/h7-10,12-13,24H,5-6,11,14H2,1-4H3
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Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248657
PNG
((E)-2-{3-[(Ethylmethylamino)methyl]benzylidene}-5,...)
Show SMILES CCN(C)Cc1cccc(\C=C2/Cc3cc(OC)c(OC)cc3C2=O)c1
Show InChI InChI=1S/C22H25NO3/c1-5-23(2)14-16-8-6-7-15(9-16)10-18-11-17-12-20(25-3)21(26-4)13-19(17)22(18)24/h6-10,12-13H,5,11,14H2,1-4H3/b18-10+
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n/an/a 490n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248878
PNG
(5,6-Dimethoxy-2-{4-[(pyrrolidin-1-yl)methyl] benzy...)
Show SMILES COc1cc2oc(Cc3ccc(CN4CCCC4)cc3)c(O)c2cc1OC
Show InChI InChI=1S/C22H25NO4/c1-25-19-12-17-18(13-20(19)26-2)27-21(22(17)24)11-15-5-7-16(8-6-15)14-23-9-3-4-10-23/h5-8,12-13,24H,3-4,9-11,14H2,1-2H3
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n/an/a 620n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248879
PNG
(5,6-Dimethoxy-2-{3-[(piperidin-1-yl)methyl]-benzyl...)
Show SMILES COc1cc2CC(Cc3cccc(CN4CCCCC4)c3)C(=O)c2cc1OC
Show InChI InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-7-6-8-18(11-17)16-25-9-4-3-5-10-25/h6-8,11,14-15,20H,3-5,9-10,12-13,16H2,1-2H3
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n/an/a 660n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248815
PNG
(2-{3-[(Ethylmethylamino)methyl]benzyl}-5,6-dimetho...)
Show SMILES CCN(C)Cc1cccc(CC2Cc3cc(OC)c(OC)cc3C2=O)c1
Show InChI InChI=1S/C22H27NO3/c1-5-23(2)14-16-8-6-7-15(9-16)10-18-11-17-12-20(25-3)21(26-4)13-19(17)22(18)24/h6-9,12-13,18H,5,10-11,14H2,1-4H3
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n/an/a 690n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248713
PNG
((Z)-2-{3-[(Ethylmethylamino)methyl]benzylidene}-5,...)
Show SMILES CCN(C)Cc1cccc(\C=C2/Oc3cc(OC)c(OC)cc3C2=O)c1
Show InChI InChI=1S/C21H23NO4/c1-5-22(2)13-15-8-6-7-14(9-15)10-20-21(23)16-11-18(24-3)19(25-4)12-17(16)26-20/h6-12H,5,13H2,1-4H3/b20-10-
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n/an/a 700n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248846
PNG
(2-{3-[(Diethylamino)methyl]benzyl}-5,6-dimethoxybe...)
Show SMILES CCN(CC)Cc1cccc(Cc2oc3cc(OC)c(OC)cc3c2O)c1
Show InChI InChI=1S/C22H27NO4/c1-5-23(6-2)14-16-9-7-8-15(10-16)11-21-22(24)17-12-19(25-3)20(26-4)13-18(17)27-21/h7-10,12-13,24H,5-6,11,14H2,1-4H3
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n/an/a 1.07E+3n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248716
PNG
((Z)-2-{3-[(Diethylamino)methyl]benzylidene}-5,6-di...)
Show SMILES CCN(CC)Cc1cccc(\C=C2/Oc3cc(OC)c(OC)cc3C2=O)c1
Show InChI InChI=1S/C22H25NO4/c1-5-23(6-2)14-16-9-7-8-15(10-16)11-21-22(24)17-12-19(25-3)20(26-4)13-18(17)27-21/h7-13H,5-6,14H2,1-4H3/b21-11-
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n/an/a 1.18E+3n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248784
PNG
(2-{4-[(Dimethylamino)methyl]benzyl}-5,6-dimethoxy-...)
Show SMILES COc1cc2CC(Cc3ccc(CN(C)C)cc3)C(=O)c2cc1OC
Show InChI InChI=1S/C21H25NO3/c1-22(2)13-15-7-5-14(6-8-15)9-17-10-16-11-19(24-3)20(25-4)12-18(16)21(17)23/h5-8,11-12,17H,9-10,13H2,1-4H3
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n/an/a 1.38E+3n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM10620
PNG
((S)-3-(1-(dimethylamino)ethyl)phenyl ethyl(methyl)...)
Show SMILES [H][C@@](C)(N(C)C)c1cccc(OC(=O)N(C)CC)c1
Show InChI InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1
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n/an/a 1.41E+3n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248818
PNG
(2-{3-[(Diethylamino)methyl]benzyl}-5,6-dimethoxy-2...)
Show SMILES CCN(CC)Cc1cccc(CC2Cc3cc(OC)c(OC)cc3C2=O)c1
Show InChI InChI=1S/C23H29NO3/c1-5-24(6-2)15-17-9-7-8-16(10-17)11-19-12-18-13-21(26-3)22(27-4)14-20(18)23(19)25/h7-10,13-14,19H,5-6,11-12,15H2,1-4H3
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n/an/a 1.48E+3n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248817
PNG
(2-{3-[(Ethylmethylamino)methyl]benzyl}-5,6-dimetho...)
Show SMILES CCN(C)Cc1cccc(Cc2oc3cc(OC)c(OC)cc3c2O)c1
Show InChI InChI=1S/C21H25NO4/c1-5-22(2)13-15-8-6-7-14(9-15)10-20-21(23)16-11-18(24-3)19(25-4)12-17(16)26-20/h6-9,11-12,23H,5,10,13H2,1-4H3
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n/an/a 1.54E+3n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM10620
PNG
((S)-3-(1-(dimethylamino)ethyl)phenyl ethyl(methyl)...)
Show SMILES [H][C@@](C)(N(C)C)c1cccc(OC(=O)N(C)CC)c1
Show InChI InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1
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n/an/a 2.07E+3n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248636
PNG
((E)-2-{3-[(Dimethylamino)methyl]benzylidene}-5,6-d...)
Show SMILES COc1cc2C\C(=C/c3cccc(CN(C)C)c3)C(=O)c2cc1OC
Show InChI InChI=1S/C21H23NO3/c1-22(2)13-15-7-5-6-14(8-15)9-17-10-16-11-19(24-3)20(25-4)12-18(16)21(17)23/h5-9,11-12H,10,13H2,1-4H3/b17-9+
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n/an/a 2.14E+3n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248848
PNG
(5,6-Dimethoxy-2-{3-[(pyrrolidin-1-yl)methyl]-benzy...)
Show SMILES COc1cc2CC(Cc3cccc(CN4CCCC4)c3)C(=O)c2cc1OC
Show InChI InChI=1S/C23H27NO3/c1-26-21-13-18-12-19(23(25)20(18)14-22(21)27-2)11-16-6-5-7-17(10-16)15-24-8-3-4-9-24/h5-7,10,13-14,19H,3-4,8-9,11-12,15H2,1-2H3
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n/an/a 2.58E+3n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM8960
PNG
((+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimet...)
Show SMILES COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC
Show InChI InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3
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n/an/a 2.77E+3n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248783
PNG
(2-{3-[(Dimethylamino)methyl]benzyl}-5,6-dimethoxy-...)
Show SMILES COc1cc2CC(Cc3cccc(CN(C)C)c3)C(=O)c2cc1OC
Show InChI InChI=1S/C21H25NO3/c1-22(2)13-15-7-5-6-14(8-15)9-17-10-16-11-19(24-3)20(25-4)12-18(16)21(17)23/h5-8,11-12,17H,9-10,13H2,1-4H3
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n/an/a 3.74E+3n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50248850
PNG
(5,6-Dimethoxy-2-{3-[(pyrrolidin-1-yl)methyl]-benzy...)
Show SMILES COc1cc2oc(Cc3cccc(CN4CCCC4)c3)c(O)c2cc1OC
Show InChI InChI=1S/C22H25NO4/c1-25-19-12-17-18(13-20(19)26-2)27-21(22(17)24)11-15-6-5-7-16(10-15)14-23-8-3-4-9-23/h5-7,10,12-13,24H,3-4,8-9,11,14H2,1-2H3
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n/an/a 7.02E+3n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of AChE in rat cortex after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248819
PNG
(2-{4-[(Diethylamino)methyl]benzyl}-5,6-dimethoxy2,...)
Show SMILES CCN(CC)Cc1ccc(CC2Cc3cc(OC)c(OC)cc3C2=O)cc1
Show InChI InChI=1S/C23H29NO3/c1-5-24(6-2)15-17-9-7-16(8-10-17)11-19-12-18-13-21(26-3)22(27-4)14-20(18)23(19)25/h7-10,13-14,19H,5-6,11-12,15H2,1-4H3
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n/an/a 1.17E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248847
PNG
(2-{4-[(Diethylamino)methyl]benzyl}-5,6-dimethoxybe...)
Show SMILES CCN(CC)Cc1ccc(Cc2oc3cc(OC)c(OC)cc3c2O)cc1
Show InChI InChI=1S/C22H27NO4/c1-5-23(6-2)14-16-9-7-15(8-10-16)11-21-22(24)17-12-19(25-3)20(26-4)13-18(17)27-21/h7-10,12-13,24H,5-6,11,14H2,1-4H3
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n/an/a 1.64E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248815
PNG
(2-{3-[(Ethylmethylamino)methyl]benzyl}-5,6-dimetho...)
Show SMILES CCN(C)Cc1cccc(CC2Cc3cc(OC)c(OC)cc3C2=O)c1
Show InChI InChI=1S/C22H27NO3/c1-5-23(2)14-16-8-6-7-15(9-16)10-18-11-17-12-20(25-3)21(26-4)13-19(17)22(18)24/h6-9,12-13,18H,5,10-11,14H2,1-4H3
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n/an/a 1.85E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248712
PNG
((E)-2-{4-[(Ethylmethylamino)methyl]benzylidene}-5,...)
Show SMILES CCN(C)Cc1ccc(\C=C2/Cc3cc(OC)c(OC)cc3C2=O)cc1
Show InChI InChI=1S/C22H25NO3/c1-5-23(2)14-16-8-6-15(7-9-16)10-18-11-17-12-20(25-3)21(26-4)13-19(17)22(18)24/h6-10,12-13H,5,11,14H2,1-4H3/b18-10+
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n/an/a 2.01E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248713
PNG
((Z)-2-{3-[(Ethylmethylamino)methyl]benzylidene}-5,...)
Show SMILES CCN(C)Cc1cccc(\C=C2/Oc3cc(OC)c(OC)cc3C2=O)c1
Show InChI InChI=1S/C21H23NO4/c1-5-22(2)13-15-8-6-7-14(9-15)10-20-21(23)16-11-18(24-3)19(25-4)12-17(16)26-20/h6-12H,5,13H2,1-4H3/b20-10-
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n/an/a 2.36E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248783
PNG
(2-{3-[(Dimethylamino)methyl]benzyl}-5,6-dimethoxy-...)
Show SMILES COc1cc2CC(Cc3cccc(CN(C)C)c3)C(=O)c2cc1OC
Show InChI InChI=1S/C21H25NO3/c1-22(2)13-15-7-5-6-14(8-15)9-17-10-16-11-19(24-3)20(25-4)12-18(16)21(17)23/h5-8,11-12,17H,9-10,13H2,1-4H3
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n/an/a 2.52E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248817
PNG
(2-{3-[(Ethylmethylamino)methyl]benzyl}-5,6-dimetho...)
Show SMILES CCN(C)Cc1cccc(Cc2oc3cc(OC)c(OC)cc3c2O)c1
Show InChI InChI=1S/C21H25NO4/c1-5-22(2)13-15-8-6-7-14(9-15)10-20-21(23)16-11-18(24-3)19(25-4)12-17(16)26-20/h6-9,11-12,23H,5,10,13H2,1-4H3
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n/an/a 2.59E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248747
PNG
((E)-5,6-Dimethoxy-2-{4-[(pyrrolidin-1-yl)methyl]-b...)
Show SMILES COc1cc2C\C(=C/c3ccc(CN4CCCC4)cc3)C(=O)c2cc1OC
Show InChI InChI=1S/C23H25NO3/c1-26-21-13-18-12-19(23(25)20(18)14-22(21)27-2)11-16-5-7-17(8-6-16)15-24-9-3-4-10-24/h5-8,11,13-14H,3-4,9-10,12,15H2,1-2H3/b19-11+
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n/an/a 2.66E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248818
PNG
(2-{3-[(Diethylamino)methyl]benzyl}-5,6-dimethoxy-2...)
Show SMILES CCN(CC)Cc1cccc(CC2Cc3cc(OC)c(OC)cc3C2=O)c1
Show InChI InChI=1S/C23H29NO3/c1-5-24(6-2)15-17-9-7-8-16(10-17)11-19-12-18-13-21(26-3)22(27-4)14-20(18)23(19)25/h7-10,13-14,19H,5-6,11-12,15H2,1-4H3
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n/an/a 3.20E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248849
PNG
(5,6-Dimethoxy-2-{4-[(pyrrolidin-1-yl)methyl]-benzy...)
Show SMILES COc1cc2CC(Cc3ccc(CN4CCCC4)cc3)C(=O)c2cc1OC
Show InChI InChI=1S/C23H27NO3/c1-26-21-13-18-12-19(23(25)20(18)14-22(21)27-2)11-16-5-7-17(8-6-16)15-24-9-3-4-10-24/h5-8,13-14,19H,3-4,9-12,15H2,1-2H3
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n/an/a 3.32E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248816
PNG
(2-{4-[(Ethylmethylamino)methyl]benzyl}-5,6-dimetho...)
Show SMILES CCN(C)Cc1ccc(CC2Cc3cc(OC)c(OC)cc3C2=O)cc1
Show InChI InChI=1S/C22H27NO3/c1-5-23(2)14-16-8-6-15(7-9-16)10-18-11-17-12-20(25-3)21(26-4)13-19(17)22(18)24/h6-9,12-13,18H,5,10-11,14H2,1-4H3
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n/an/a 3.45E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248749
PNG
((Z)-5,6-Dimethoxy-2-{4-[(pyrrolidin-1-yl)methyl]-b...)
Show SMILES COc1cc2O\C(=C/c3ccc(CN4CCCC4)cc3)C(=O)c2cc1OC
Show InChI InChI=1S/C22H23NO4/c1-25-19-12-17-18(13-20(19)26-2)27-21(22(17)24)11-15-5-7-16(8-6-15)14-23-9-3-4-10-23/h5-8,11-13H,3-4,9-10,14H2,1-2H3/b21-11-
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n/an/a 3.64E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248657
PNG
((E)-2-{3-[(Ethylmethylamino)methyl]benzylidene}-5,...)
Show SMILES CCN(C)Cc1cccc(\C=C2/Cc3cc(OC)c(OC)cc3C2=O)c1
Show InChI InChI=1S/C22H25NO3/c1-5-23(2)14-16-8-6-7-15(9-16)10-18-11-17-12-20(25-3)21(26-4)13-19(17)22(18)24/h6-10,12-13H,5,11,14H2,1-4H3/b18-10+
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n/an/a 3.68E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248846
PNG
(2-{3-[(Diethylamino)methyl]benzyl}-5,6-dimethoxybe...)
Show SMILES CCN(CC)Cc1cccc(Cc2oc3cc(OC)c(OC)cc3c2O)c1
Show InChI InChI=1S/C22H27NO4/c1-5-23(6-2)14-16-9-7-8-15(10-16)11-21-22(24)17-12-19(25-3)20(26-4)13-18(17)27-21/h7-10,12-13,24H,5-6,11,14H2,1-4H3
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n/an/a 3.82E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248784
PNG
(2-{4-[(Dimethylamino)methyl]benzyl}-5,6-dimethoxy-...)
Show SMILES COc1cc2CC(Cc3ccc(CN(C)C)cc3)C(=O)c2cc1OC
Show InChI InChI=1S/C21H25NO3/c1-22(2)13-15-7-5-14(6-8-15)9-17-10-16-11-19(24-3)20(25-4)12-18(16)21(17)23/h5-8,11-12,17H,9-10,13H2,1-4H3
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n/an/a 4.07E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248746
PNG
((E)-5,6-Dimethoxy-2-{3-[(pyrrolidin-1-yl)methyl]-b...)
Show SMILES COc1cc2C\C(=C/c3cccc(CN4CCCC4)c3)C(=O)c2cc1OC
Show InChI InChI=1S/C23H25NO3/c1-26-21-13-18-12-19(23(25)20(18)14-22(21)27-2)11-16-6-5-7-17(10-16)15-24-8-3-4-9-24/h5-7,10-11,13-14H,3-4,8-9,12,15H2,1-2H3/b19-11+
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n/an/a 4.16E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248848
PNG
(5,6-Dimethoxy-2-{3-[(pyrrolidin-1-yl)methyl]-benzy...)
Show SMILES COc1cc2CC(Cc3cccc(CN4CCCC4)c3)C(=O)c2cc1OC
Show InChI InChI=1S/C23H27NO3/c1-26-21-13-18-12-19(23(25)20(18)14-22(21)27-2)11-16-6-5-7-17(10-16)15-24-8-3-4-9-24/h5-7,10,13-14,19H,3-4,8-9,11-12,15H2,1-2H3
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n/an/a 4.22E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248782
PNG
((Z)-5,6-Dimethoxy-2-{3-[(piperidin-1-yl)methyl]-be...)
Show SMILES COc1cc2O\C(=C/c3cccc(CN4CCCCC4)c3)C(=O)c2cc1OC
Show InChI InChI=1S/C23H25NO4/c1-26-20-13-18-19(14-21(20)27-2)28-22(23(18)25)12-16-7-6-8-17(11-16)15-24-9-4-3-5-10-24/h6-8,11-14H,3-5,9-10,15H2,1-2H3/b22-12-
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n/an/a 4.50E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248745
PNG
((Z)-2-{4-[(Diethylamino)methyl]benzylidene}-5,6-di...)
Show SMILES CCN(CC)Cc1ccc(\C=C2/Oc3cc(OC)c(OC)cc3C2=O)cc1
Show InChI InChI=1S/C22H25NO4/c1-5-23(6-2)14-16-9-7-15(8-10-16)11-21-22(24)17-12-19(25-3)20(26-4)13-18(17)27-21/h7-13H,5-6,14H2,1-4H3/b21-11-
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n/an/a 4.79E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248880
PNG
(5,6-Dimethoxy-2-{4-[(piperidin-1-yl)methyl]-benzyl...)
Show SMILES COc1cc2CC(Cc3ccc(CN4CCCCC4)cc3)C(=O)c2cc1OC
Show InChI InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-6-8-18(9-7-17)16-25-10-4-3-5-11-25/h6-9,14-15,20H,3-5,10-13,16H2,1-2H3
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n/an/a 4.83E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248878
PNG
(5,6-Dimethoxy-2-{4-[(pyrrolidin-1-yl)methyl] benzy...)
Show SMILES COc1cc2oc(Cc3ccc(CN4CCCC4)cc3)c(O)c2cc1OC
Show InChI InChI=1S/C22H25NO4/c1-25-19-12-17-18(13-20(19)26-2)27-21(22(17)24)11-15-5-7-16(8-6-15)14-23-9-3-4-10-23/h5-8,12-13,24H,3-4,9-11,14H2,1-2H3
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n/an/a 4.98E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248780
PNG
((E)-5,6-Dimethoxy-2-{3-[(piperidin-1-yl)methyl]-be...)
Show SMILES COc1cc2C\C(=C/c3cccc(CN4CCCCC4)c3)C(=O)c2cc1OC
Show InChI InChI=1S/C24H27NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-7-6-8-18(11-17)16-25-9-4-3-5-10-25/h6-8,11-12,14-15H,3-5,9-10,13,16H2,1-2H3/b20-12+
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n/an/a 5.52E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248850
PNG
(5,6-Dimethoxy-2-{3-[(pyrrolidin-1-yl)methyl]-benzy...)
Show SMILES COc1cc2oc(Cc3cccc(CN4CCCC4)c3)c(O)c2cc1OC
Show InChI InChI=1S/C22H25NO4/c1-25-19-12-17-18(13-20(19)26-2)27-21(22(17)24)11-15-6-5-7-16(10-15)14-23-8-3-4-9-23/h5-7,10,12-13,24H,3-4,8-9,11,14H2,1-2H3
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n/an/a 5.76E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248716
PNG
((Z)-2-{3-[(Diethylamino)methyl]benzylidene}-5,6-di...)
Show SMILES CCN(CC)Cc1cccc(\C=C2/Oc3cc(OC)c(OC)cc3C2=O)c1
Show InChI InChI=1S/C22H25NO4/c1-5-23(6-2)14-16-9-7-8-15(10-16)11-21-22(24)17-12-19(25-3)20(26-4)13-18(17)27-21/h7-13H,5-6,14H2,1-4H3/b21-11-
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n/an/a 6.51E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248879
PNG
(5,6-Dimethoxy-2-{3-[(piperidin-1-yl)methyl]-benzyl...)
Show SMILES COc1cc2CC(Cc3cccc(CN4CCCCC4)c3)C(=O)c2cc1OC
Show InChI InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-7-6-8-18(11-17)16-25-9-4-3-5-10-25/h6-8,11,14-15,20H,3-5,9-10,12-13,16H2,1-2H3
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n/an/a 7.04E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248714
PNG
((E)-2-{3-[(Diethylamino)methyl]benzylidene}-5,6-di...)
Show SMILES CCN(CC)Cc1cccc(\C=C2/Cc3cc(OC)c(OC)cc3C2=O)c1
Show InChI InChI=1S/C23H27NO3/c1-5-24(6-2)15-17-9-7-8-16(10-17)11-19-12-18-13-21(26-3)22(27-4)14-20(18)23(19)25/h7-11,13-14H,5-6,12,15H2,1-4H3/b19-11+
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n/an/a 7.10E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248748
PNG
((Z)-5,6-Dimethoxy-2-{3-[(pyrrolidin-1-yl)methyl]-b...)
Show SMILES COc1cc2O\C(=C/c3cccc(CN4CCCC4)c3)C(=O)c2cc1OC
Show InChI InChI=1S/C22H23NO4/c1-25-19-12-17-18(13-20(19)26-2)27-21(22(17)24)11-15-6-5-7-16(10-15)14-23-8-3-4-9-23/h5-7,10-13H,3-4,8-9,14H2,1-2H3/b21-11-
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n/an/a 7.20E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248715
PNG
((E)-2-{4-[(Diethylamino)methyl]benzylidene}-5,6-di...)
Show SMILES CCN(CC)Cc1ccc(\C=C2/Cc3cc(OC)c(OC)cc3C2=O)cc1
Show InChI InChI=1S/C23H27NO3/c1-5-24(6-2)15-17-9-7-16(8-10-17)11-19-12-18-13-21(26-3)22(27-4)14-20(18)23(19)25/h7-11,13-14H,5-6,12,15H2,1-4H3/b19-11+
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n/an/a 8.20E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248781
PNG
((E)-5,6-Dimethoxy-2-{4-[(piperidin-1-yl)methyl]-be...)
Show SMILES COc1cc2C\C(=C/c3ccc(CN4CCCCC4)cc3)C(=O)c2cc1OC
Show InChI InChI=1S/C24H27NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-6-8-18(9-7-17)16-25-10-4-3-5-11-25/h6-9,12,14-15H,3-5,10-11,13,16H2,1-2H3/b20-12+
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n/an/a 8.46E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248636
PNG
((E)-2-{3-[(Dimethylamino)methyl]benzylidene}-5,6-d...)
Show SMILES COc1cc2C\C(=C/c3cccc(CN(C)C)c3)C(=O)c2cc1OC
Show InChI InChI=1S/C21H23NO3/c1-22(2)13-15-7-5-6-14(8-15)9-17-10-16-11-19(24-3)20(25-4)12-18(16)21(17)23/h5-9,11-12H,10,13H2,1-4H3/b17-9+
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n/an/a 8.93E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248881
PNG
(5,6-Dimethoxy-2-{3-[(piperidin-1-yl)methyl]-benzyl...)
Show SMILES COc1cc2oc(Cc3cccc(CN4CCCCC4)c3)c(O)c2cc1OC
Show InChI InChI=1S/C23H27NO4/c1-26-20-13-18-19(14-21(20)27-2)28-22(23(18)25)12-16-7-6-8-17(11-16)15-24-9-4-3-5-10-24/h6-8,11,13-14,25H,3-5,9-10,12,15H2,1-2H3
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n/an/a 9.81E+4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM50248637
PNG
((E)-2-{4-[(Dimethylamino)methyl]benzylidene}-5,6-d...)
Show SMILES COc1cc2C\C(=C/c3ccc(CN(C)C)cc3)C(=O)c2cc1OC
Show InChI InChI=1S/C21H23NO3/c1-22(2)13-15-7-5-14(6-8-15)9-17-10-16-11-19(24-3)20(25-4)12-18(16)21(17)23/h5-9,11-12H,10,13H2,1-4H3/b17-9+
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n/an/a 3.15E+5n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of BChE in rat serum after 15 mins by modified Ellman method


Eur J Med Chem 44: 7-17 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.003
BindingDB Entry DOI: 10.7270/Q29W0F8B
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%