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Compile Data Set for Download or QSAR

Found 59 hits Enz. Inhib. hit(s) with all data for entry = 50040547   
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
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395966
PNG
(CHEMBL2164905)
Show SMILES CN1CCN(CC1)C(=O)[C@@](F)(Cc1ccccc1)c1ccccc1 |r|
Show InChI InChI=1S/C20H23FN2O/c1-22-12-14-23(15-13-22)19(24)20(21,18-10-6-3-7-11-18)16-17-8-4-2-5-9-17/h2-11H,12-16H2,1H3/t20-/m1/s1
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n/an/a 17.8n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395966
PNG
(CHEMBL2164905)
Show SMILES CN1CCN(CC1)C(=O)[C@@](F)(Cc1ccccc1)c1ccccc1 |r|
Show InChI InChI=1S/C20H23FN2O/c1-22-12-14-23(15-13-22)19(24)20(21,18-10-6-3-7-11-18)16-17-8-4-2-5-9-17/h2-11H,12-16H2,1H3/t20-/m1/s1
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n/an/a 18n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395965
PNG
(CHEMBL2164910)
Show SMILES CN1CCN(CC1)C(=O)C(F)(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C20H23FN2O/c1-22-12-14-23(15-13-22)19(24)20(21,18-10-6-3-7-11-18)16-17-8-4-2-5-9-17/h2-11H,12-16H2,1H3
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n/an/a 29n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50396000
PNG
(CHEMBL2164906)
Show SMILES CN1CCN(CC1)C(=O)[C@H](Cc1ccccc1)c1ccccc1 |r|
Show InChI InChI=1S/C20H24N2O/c1-21-12-14-22(15-13-21)20(23)19(18-10-6-3-7-11-18)16-17-8-4-2-5-9-17/h2-11,19H,12-16H2,1H3/t19-/m1/s1
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n/an/a 33n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395973
PNG
(CHEMBL2164895)
Show SMILES CCN1CCCN(CC1)C(=O)C(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C22H28N2O/c1-2-23-14-9-15-24(17-16-23)22(25)21(20-12-7-4-8-13-20)18-19-10-5-3-6-11-19/h3-8,10-13,21H,2,9,14-18H2,1H3
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n/an/a 37.1n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395973
PNG
(CHEMBL2164895)
Show SMILES CCN1CCCN(CC1)C(=O)C(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C22H28N2O/c1-2-23-14-9-15-24(17-16-23)22(25)21(20-12-7-4-8-13-20)18-19-10-5-3-6-11-19/h3-8,10-13,21H,2,9,14-18H2,1H3
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n/an/a 38n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395983
PNG
(CHEMBL2164911)
Show SMILES CN1CCN(CC1)C(=O)C(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C20H24N2O/c1-21-12-14-22(15-13-21)20(23)19(18-10-6-3-7-11-18)16-17-8-4-2-5-9-17/h2-11,19H,12-16H2,1H3
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n/an/a 43.6n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395983
PNG
(CHEMBL2164911)
Show SMILES CN1CCN(CC1)C(=O)C(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C20H24N2O/c1-21-12-14-22(15-13-21)20(23)19(18-10-6-3-7-11-18)16-17-8-4-2-5-9-17/h2-11,19H,12-16H2,1H3
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n/an/a 44n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M5


(Homo sapiens (Human))
BDBM50395966
PNG
(CHEMBL2164905)
Show SMILES CN1CCN(CC1)C(=O)[C@@](F)(Cc1ccccc1)c1ccccc1 |r|
Show InChI InChI=1S/C20H23FN2O/c1-22-12-14-23(15-13-22)19(24)20(21,18-10-6-3-7-11-18)16-17-8-4-2-5-9-17/h2-11H,12-16H2,1H3/t20-/m1/s1
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n/an/a 82n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M5 receptor by calcium mobilization assay


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395978
PNG
(CHEMBL2164918)
Show SMILES CCN1CCN(CC1(C)C)C(=O)C(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H30N2O/c1-4-25-16-15-24(18-23(25,2)3)22(26)21(20-13-9-6-10-14-20)17-19-11-7-5-8-12-19/h5-14,21H,4,15-18H2,1-3H3
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n/an/a 89.1n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395978
PNG
(CHEMBL2164918)
Show SMILES CCN1CCN(CC1(C)C)C(=O)C(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H30N2O/c1-4-25-16-15-24(18-23(25,2)3)22(26)21(20-13-9-6-10-14-20)17-19-11-7-5-8-12-19/h5-14,21H,4,15-18H2,1-3H3
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n/an/a 90n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395974
PNG
(CHEMBL2164894)
Show SMILES CN1CCCN(CC1)C(=O)C(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C21H26N2O/c1-22-13-8-14-23(16-15-22)21(24)20(19-11-6-3-7-12-19)17-18-9-4-2-5-10-18/h2-7,9-12,20H,8,13-17H2,1H3
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n/an/a 95.5n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395980
PNG
(CHEMBL2164916)
Show SMILES CC1CN(CCN1C)C(=O)C(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C21H26N2O/c1-17-16-23(14-13-22(17)2)21(24)20(19-11-7-4-8-12-19)15-18-9-5-3-6-10-18/h3-12,17,20H,13-16H2,1-2H3
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n/an/a 100n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395974
PNG
(CHEMBL2164894)
Show SMILES CN1CCCN(CC1)C(=O)C(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C21H26N2O/c1-22-13-8-14-23(16-15-22)21(24)20(19-11-6-3-7-12-19)17-18-9-4-2-5-10-18/h2-7,9-12,20H,8,13-17H2,1H3
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n/an/a 100n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395972
PNG
(CHEMBL2164896)
Show SMILES CC(C)N1CCCN(CC1)C(=O)C(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H30N2O/c1-19(2)24-14-9-15-25(17-16-24)23(26)22(21-12-7-4-8-13-21)18-20-10-5-3-6-11-20/h3-8,10-13,19,22H,9,14-18H2,1-2H3
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n/an/a 100n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395980
PNG
(CHEMBL2164916)
Show SMILES CC1CN(CCN1C)C(=O)C(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C21H26N2O/c1-17-16-23(14-13-22(17)2)21(24)20(19-11-7-4-8-12-19)15-18-9-5-3-6-10-18/h3-12,17,20H,13-16H2,1-2H3
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n/an/a 105n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395972
PNG
(CHEMBL2164896)
Show SMILES CC(C)N1CCCN(CC1)C(=O)C(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H30N2O/c1-19(2)24-14-9-15-25(17-16-24)23(26)22(21-12-7-4-8-13-21)18-20-10-5-3-6-11-20/h3-8,10-13,19,22H,9,14-18H2,1-2H3
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n/an/a 105n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395975
PNG
(CHEMBL2164888)
Show SMILES CN(C)CCOC(=O)C(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C19H23NO2/c1-20(2)13-14-22-19(21)18(17-11-7-4-8-12-17)15-16-9-5-3-6-10-16/h3-12,18H,13-15H2,1-2H3
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n/an/a 138n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM50395966
PNG
(CHEMBL2164905)
Show SMILES CN1CCN(CC1)C(=O)[C@@](F)(Cc1ccccc1)c1ccccc1 |r|
Show InChI InChI=1S/C20H23FN2O/c1-22-12-14-23(15-13-22)19(24)20(21,18-10-6-3-7-11-18)16-17-8-4-2-5-9-17/h2-11H,12-16H2,1H3/t20-/m1/s1
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n/an/a 140n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M4 receptor by calcium mobilization assay


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395975
PNG
(CHEMBL2164888)
Show SMILES CN(C)CCOC(=O)C(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C19H23NO2/c1-20(2)13-14-22-19(21)18(17-11-7-4-8-12-17)15-16-9-5-3-6-10-16/h3-12,18H,13-15H2,1-2H3
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n/an/a 140n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395999
PNG
(CHEMBL1426275)
Show SMILES CN1CCN(CC1)C(=O)C(=C/c1ccccc1)\c1ccccc1
Show InChI InChI=1S/C20H22N2O/c1-21-12-14-22(15-13-21)20(23)19(18-10-6-3-7-11-18)16-17-8-4-2-5-9-17/h2-11,16H,12-15H2,1H3/b19-16-
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395970
PNG
(CHEMBL2164900)
Show SMILES CN1CCN(CC1)C(=O)[C@H](Oc1ccccc1)c1ccccc1 |r|
Show InChI InChI=1S/C19H22N2O2/c1-20-12-14-21(15-13-20)19(22)18(16-8-4-2-5-9-16)23-17-10-6-3-7-11-17/h2-11,18H,12-15H2,1H3/t18-/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395970
PNG
(CHEMBL2164900)
Show SMILES CN1CCN(CC1)C(=O)[C@H](Oc1ccccc1)c1ccccc1 |r|
Show InChI InChI=1S/C19H22N2O2/c1-20-12-14-21(15-13-20)19(22)18(16-8-4-2-5-9-16)23-17-10-6-3-7-11-17/h2-11,18H,12-15H2,1H3/t18-/m1/s1
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n/an/a 245n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395979
PNG
(CHEMBL2164917)
Show SMILES CCN1CCN(CC1C)C(=O)C(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C22H28N2O/c1-3-23-14-15-24(17-18(23)2)22(25)21(20-12-8-5-9-13-20)16-19-10-6-4-7-11-19/h4-13,18,21H,3,14-17H2,1-2H3
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n/an/a 260n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395979
PNG
(CHEMBL2164917)
Show SMILES CCN1CCN(CC1C)C(=O)C(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C22H28N2O/c1-3-23-14-15-24(17-18(23)2)22(25)21(20-12-8-5-9-13-20)16-19-10-6-4-7-11-19/h4-13,18,21H,3,14-17H2,1-2H3
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n/an/a 263n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395981
PNG
(CHEMBL2164913)
Show SMILES CC(C)N1CCN(CC1)C(=O)C(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C22H28N2O/c1-18(2)23-13-15-24(16-14-23)22(25)21(20-11-7-4-8-12-20)17-19-9-5-3-6-10-19/h3-12,18,21H,13-17H2,1-2H3
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n/an/a 437n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395981
PNG
(CHEMBL2164913)
Show SMILES CC(C)N1CCN(CC1)C(=O)C(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C22H28N2O/c1-18(2)23-13-15-24(16-14-23)22(25)21(20-11-7-4-8-12-20)17-19-9-5-3-6-10-19/h3-12,18,21H,13-17H2,1-2H3
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n/an/a 440n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395968
PNG
(CHEMBL2164903)
Show SMILES CN1CCN(CC1)C(=O)C(Cc1cccnc1)c1ccccc1
Show InChI InChI=1S/C19H23N3O/c1-21-10-12-22(13-11-21)19(23)18(17-7-3-2-4-8-17)14-16-6-5-9-20-15-16/h2-9,15,18H,10-14H2,1H3
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n/an/a 500n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395968
PNG
(CHEMBL2164903)
Show SMILES CN1CCN(CC1)C(=O)C(Cc1cccnc1)c1ccccc1
Show InChI InChI=1S/C19H23N3O/c1-21-10-12-22(13-11-21)19(23)18(17-7-3-2-4-8-17)14-16-6-5-9-20-15-16/h2-9,15,18H,10-14H2,1H3
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n/an/a 501n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395982
PNG
(CHEMBL2164912)
Show SMILES CCN1CCN(CC1)C(=O)C(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C21H26N2O/c1-2-22-13-15-23(16-14-22)21(24)20(19-11-7-4-8-12-19)17-18-9-5-3-6-10-18/h3-12,20H,2,13-17H2,1H3
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n/an/a 570n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395982
PNG
(CHEMBL2164912)
Show SMILES CCN1CCN(CC1)C(=O)C(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C21H26N2O/c1-2-22-13-15-23(16-14-22)21(24)20(19-11-7-4-8-12-19)17-18-9-5-3-6-10-18/h3-12,20H,2,13-17H2,1H3
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n/an/a 575n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395969
PNG
(CHEMBL2164902)
Show SMILES CN1CCN(CC1)C(=O)C(Cc1ccncc1)c1ccccc1
Show InChI InChI=1S/C19H23N3O/c1-21-11-13-22(14-12-21)19(23)18(17-5-3-2-4-6-17)15-16-7-9-20-10-8-16/h2-10,18H,11-15H2,1H3
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n/an/a 871n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395969
PNG
(CHEMBL2164902)
Show SMILES CN1CCN(CC1)C(=O)C(Cc1ccncc1)c1ccccc1
Show InChI InChI=1S/C19H23N3O/c1-21-11-13-22(14-12-21)19(23)18(17-5-3-2-4-6-17)15-16-7-9-20-10-8-16/h2-10,18H,11-15H2,1H3
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n/an/a 880n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50395966
PNG
(CHEMBL2164905)
Show SMILES CN1CCN(CC1)C(=O)[C@@](F)(Cc1ccccc1)c1ccccc1 |r|
Show InChI InChI=1S/C20H23FN2O/c1-22-12-14-23(15-13-22)19(24)20(21,18-10-6-3-7-11-18)16-17-8-4-2-5-9-17/h2-11H,12-16H2,1H3/t20-/m1/s1
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n/an/a>1.50E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M3 receptor by calcium mobilization assay


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50395966
PNG
(CHEMBL2164905)
Show SMILES CN1CCN(CC1)C(=O)[C@@](F)(Cc1ccccc1)c1ccccc1 |r|
Show InChI InChI=1S/C20H23FN2O/c1-22-12-14-23(15-13-22)19(24)20(21,18-10-6-3-7-11-18)16-17-8-4-2-5-9-17/h2-11H,12-16H2,1H3/t20-/m1/s1
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n/an/a>1.50E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor by calcium mobilization assay


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395976
PNG
(CHEMBL2164923)
Show SMILES O=C(C(Cc1ccccc1)c1ccccc1)N1CCN2CCCCC2C1
Show InChI InChI=1S/C23H28N2O/c26-23(25-16-15-24-14-8-7-13-21(24)18-25)22(20-11-5-2-6-12-20)17-19-9-3-1-4-10-19/h1-6,9-12,21-22H,7-8,13-18H2
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n/an/a 2.00E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395976
PNG
(CHEMBL2164923)
Show SMILES O=C(C(Cc1ccccc1)c1ccccc1)N1CCN2CCCCC2C1
Show InChI InChI=1S/C23H28N2O/c26-23(25-16-15-24-14-8-7-13-21(24)18-25)22(20-11-5-2-6-12-20)17-19-9-3-1-4-10-19/h1-6,9-12,21-22H,7-8,13-18H2
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n/an/a 2.00E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395971
PNG
(CHEMBL2164898)
Show SMILES O=C(C(Cc1ccccc1)c1ccccc1)N1CC[C@H]2CCCN2CC1 |r|
Show InChI InChI=1S/C23H28N2O/c26-23(25-15-13-21-12-7-14-24(21)16-17-25)22(20-10-5-2-6-11-20)18-19-8-3-1-4-9-19/h1-6,8-11,21-22H,7,12-18H2/t21-,22?/m1/s1
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n/an/a 2.13E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395971
PNG
(CHEMBL2164898)
Show SMILES O=C(C(Cc1ccccc1)c1ccccc1)N1CC[C@H]2CCCN2CC1 |r|
Show InChI InChI=1S/C23H28N2O/c26-23(25-15-13-21-12-7-14-24(21)16-17-25)22(20-10-5-2-6-11-20)18-19-8-3-1-4-9-19/h1-6,8-11,21-22H,7,12-18H2/t21-,22?/m1/s1
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n/an/a 2.14E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395967
PNG
(CHEMBL2164904)
Show SMILES CN1CCN(CC1)C(=O)[C@](F)(Cc1ccccc1)c1ccccc1 |r|
Show InChI InChI=1S/C20H23FN2O/c1-22-12-14-23(15-13-22)19(24)20(21,18-10-6-3-7-11-18)16-17-8-4-2-5-9-17/h2-11H,12-16H2,1H3/t20-/m0/s1
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n/an/a 2.40E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395967
PNG
(CHEMBL2164904)
Show SMILES CN1CCN(CC1)C(=O)[C@](F)(Cc1ccccc1)c1ccccc1 |r|
Show InChI InChI=1S/C20H23FN2O/c1-22-12-14-23(15-13-22)19(24)20(21,18-10-6-3-7-11-18)16-17-8-4-2-5-9-17/h2-11H,12-16H2,1H3/t20-/m0/s1
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n/an/a 2.40E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395998
PNG
(CHEMBL2164908)
Show SMILES CN1CCN(CC1)C(=O)C1(CC1c1ccccc1)c1ccccc1
Show InChI InChI=1S/C21H24N2O/c1-22-12-14-23(15-13-22)20(24)21(18-10-6-3-7-11-18)16-19(21)17-8-4-2-5-9-17/h2-11,19H,12-16H2,1H3
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n/an/a 2.50E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395977
PNG
(CHEMBL2164922)
Show SMILES O=C(C(Cc1ccccc1)c1ccccc1)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C24H30N2O/c27-24(26-17-13-22(14-18-26)25-15-7-8-16-25)23(21-11-5-2-6-12-21)19-20-9-3-1-4-10-20/h1-6,9-12,22-23H,7-8,13-19H2
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n/an/a 3.80E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395977
PNG
(CHEMBL2164922)
Show SMILES O=C(C(Cc1ccccc1)c1ccccc1)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C24H30N2O/c27-24(26-17-13-22(14-18-26)25-15-7-8-16-25)23(21-11-5-2-6-12-21)19-20-9-3-1-4-10-20/h1-6,9-12,22-23H,7-8,13-19H2
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n/an/a 3.80E+3n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395997
PNG
(CHEMBL2164909)
Show SMILES CN1CCN(CC1)C(=O)C(C)(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C21H26N2O/c1-21(19-11-7-4-8-12-19,17-18-9-5-3-6-10-18)20(24)23-15-13-22(2)14-16-23/h3-12H,13-17H2,1-2H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395996
PNG
(CHEMBL2164914)
Show SMILES CC(C)CN1CCN(CC1)C(=O)C(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H30N2O/c1-19(2)18-24-13-15-25(16-14-24)23(26)22(21-11-7-4-8-12-21)17-20-9-5-3-6-10-20/h3-12,19,22H,13-18H2,1-2H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395995
PNG
(CHEMBL2164915)
Show SMILES O=C(C(Cc1ccccc1)c1ccccc1)N1CCNCC1
Show InChI InChI=1S/C19H22N2O/c22-19(21-13-11-20-12-14-21)18(17-9-5-2-6-10-17)15-16-7-3-1-4-8-16/h1-10,18,20H,11-15H2
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n/an/a>1.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395994
PNG
(CHEMBL2164919)
Show SMILES C[N+]1(C)CCN(CC1)C(=O)C(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C21H27N2O/c1-23(2)15-13-22(14-16-23)21(24)20(19-11-7-4-8-12-19)17-18-9-5-3-6-10-18/h3-12,20H,13-17H2,1-2H3/q+1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395993
PNG
(CHEMBL2164920)
Show SMILES CN1CCN(C(C1)c1ccccc1)C(=O)C(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C26H28N2O/c1-27-17-18-28(25(20-27)23-15-9-4-10-16-23)26(29)24(22-13-7-3-8-14-22)19-21-11-5-2-6-12-21/h2-16,24-25H,17-20H2,1H3
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PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50395992
PNG
(CHEMBL2164921)
Show SMILES CN1CCN(CC1c1ccccc1)C(=O)C(Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C26H28N2O/c1-27-17-18-28(20-25(27)23-15-9-4-10-16-23)26(29)24(22-13-7-3-8-14-22)19-21-11-5-2-6-12-21/h2-16,24-25H,17-20H2,1H3
UniProtKB/SwissProt

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GoogleScholar
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CHEMBL
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Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor


Bioorg Med Chem Lett 22: 6923-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.011
BindingDB Entry DOI: 10.7270/Q2348MH4
More data for this
Ligand-Target Pair
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