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4 similar compounds to monomer 50201286

Compile data set for download or QSAR
Wt: 384.5
BDBM50201280
Wt: 332.4
BDBM50201283
Wt: 346.5
BDBM50201285
Wt: 318.4
BDBM50201294

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 12 hits for monomerid = 50201280,50201283,50201285,50201294   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50201280
PNG
(CHEMBL394137 | {3-[(2-adamantan-1-yl-ethylamino)-m...)
Show SMILES CN(C)C1(CNCCC23CC4CC(CC(C4)C2)C3)COc2ccccc2OC1
Show InChI InChI=1S/C24H36N2O2/c1-26(2)24(16-27-21-5-3-4-6-22(21)28-17-24)15-25-8-7-23-12-18-9-19(13-23)11-20(10-18)14-23/h3-6,18-20,25H,7-17H2,1-2H3
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0.660n/an/an/an/an/an/an/an/a



Mitsubishi Pharma Corporation

Curated by ChEMBL


Assay Description
Displacement of 1-[N-methyl- 3H]scopolamine from human muscarinic M2 receptor expressed in Sf9 cells


Bioorg Med Chem Lett 17: 925-31 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.058
BindingDB Entry DOI: 10.7270/Q2DB81HZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50201280
PNG
(CHEMBL394137 | {3-[(2-adamantan-1-yl-ethylamino)-m...)
Show SMILES CN(C)C1(CNCCC23CC4CC(CC(C4)C2)C3)COc2ccccc2OC1
Show InChI InChI=1S/C24H36N2O2/c1-26(2)24(16-27-21-5-3-4-6-22(21)28-17-24)15-25-8-7-23-12-18-9-19(13-23)11-20(10-18)14-23/h3-6,18-20,25H,7-17H2,1-2H3
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1.5n/an/an/an/an/an/an/an/a



Mitsubishi Pharma Corporation

Curated by ChEMBL


Assay Description
Displacement of 1-[N-methyl- 3H]scopolamine from human muscarinic M3 receptor expressed in Sf9 cells


Bioorg Med Chem Lett 17: 925-31 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.058
BindingDB Entry DOI: 10.7270/Q2DB81HZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50201285
PNG
(3-((2-cycloheptylethylamino)methyl)-N,N-dimethyl-3...)
Show SMILES CN(C)C1(CNCCC2CCCCCC2)COc2ccccc2OC1
Show InChI InChI=1S/C21H34N2O2/c1-23(2)21(15-22-14-13-18-9-5-3-4-6-10-18)16-24-19-11-7-8-12-20(19)25-17-21/h7-8,11-12,18,22H,3-6,9-10,13-17H2,1-2H3
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2n/an/an/an/an/an/an/an/a



Mitsubishi Pharma Corporation

Curated by ChEMBL


Assay Description
Displacement of 1-[N-methyl- 3H]scopolamine from human muscarinic M2 receptor expressed in Sf9 cells


Bioorg Med Chem Lett 17: 925-31 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.058
BindingDB Entry DOI: 10.7270/Q2DB81HZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50201294
PNG
(3-((2-cyclopentylethylamino)methyl)-N,N-dimethyl-3...)
Show SMILES CN(C)C1(CNCCC2CCCC2)COc2ccccc2OC1
Show InChI InChI=1S/C19H30N2O2/c1-21(2)19(13-20-12-11-16-7-3-4-8-16)14-22-17-9-5-6-10-18(17)23-15-19/h5-6,9-10,16,20H,3-4,7-8,11-15H2,1-2H3
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2.40n/an/an/an/an/an/an/an/a



Mitsubishi Pharma Corporation

Curated by ChEMBL


Assay Description
Displacement of 1-[N-methyl- 3H]scopolamine from human muscarinic M2 receptor expressed in Sf9 cells


Bioorg Med Chem Lett 17: 925-31 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.058
BindingDB Entry DOI: 10.7270/Q2DB81HZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50201283
PNG
(3-((2-cyclohexylethylamino)methyl)-N,N-dimethyl-3,...)
Show SMILES CN(C)C1(CNCCC2CCCCC2)COc2ccccc2OC1
Show InChI InChI=1S/C20H32N2O2/c1-22(2)20(14-21-13-12-17-8-4-3-5-9-17)15-23-18-10-6-7-11-19(18)24-16-20/h6-7,10-11,17,21H,3-5,8-9,12-16H2,1-2H3
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2.5n/an/an/an/an/an/an/an/a



Mitsubishi Pharma Corporation

Curated by ChEMBL


Assay Description
Displacement of 1-[N-methyl- 3H]scopolamine from human muscarinic M3 receptor expressed in Sf9 cells


Bioorg Med Chem Lett 17: 925-31 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.058
BindingDB Entry DOI: 10.7270/Q2DB81HZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50201285
PNG
(3-((2-cycloheptylethylamino)methyl)-N,N-dimethyl-3...)
Show SMILES CN(C)C1(CNCCC2CCCCCC2)COc2ccccc2OC1
Show InChI InChI=1S/C21H34N2O2/c1-23(2)21(15-22-14-13-18-9-5-3-4-6-10-18)16-24-19-11-7-8-12-20(19)25-17-21/h7-8,11-12,18,22H,3-6,9-10,13-17H2,1-2H3
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2.70n/an/an/an/an/an/an/an/a



Mitsubishi Pharma Corporation

Curated by ChEMBL


Assay Description
Displacement of 1-[N-methyl- 3H]scopolamine from human muscarinic M3 receptor expressed in Sf9 cells


Bioorg Med Chem Lett 17: 925-31 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.058
BindingDB Entry DOI: 10.7270/Q2DB81HZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50201294
PNG
(3-((2-cyclopentylethylamino)methyl)-N,N-dimethyl-3...)
Show SMILES CN(C)C1(CNCCC2CCCC2)COc2ccccc2OC1
Show InChI InChI=1S/C19H30N2O2/c1-21(2)19(13-20-12-11-16-7-3-4-8-16)14-22-17-9-5-6-10-18(17)23-15-19/h5-6,9-10,16,20H,3-4,7-8,11-15H2,1-2H3
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3.30n/an/an/an/an/an/an/an/a



Mitsubishi Pharma Corporation

Curated by ChEMBL


Assay Description
Displacement of 1-[N-methyl- 3H]scopolamine from human muscarinic M3 receptor expressed in Sf9 cells


Bioorg Med Chem Lett 17: 925-31 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.058
BindingDB Entry DOI: 10.7270/Q2DB81HZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50201280
PNG
(CHEMBL394137 | {3-[(2-adamantan-1-yl-ethylamino)-m...)
Show SMILES CN(C)C1(CNCCC23CC4CC(CC(C4)C2)C3)COc2ccccc2OC1
Show InChI InChI=1S/C24H36N2O2/c1-26(2)24(16-27-21-5-3-4-6-22(21)28-17-24)15-25-8-7-23-12-18-9-19(13-23)11-20(10-18)14-23/h3-6,18-20,25H,7-17H2,1-2H3
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5.90n/an/an/an/an/an/an/an/a



Mitsubishi Pharma Corporation

Curated by ChEMBL


Assay Description
Displacement of 1-[N-methyl- 3H]scopolamine from human muscarinic M1 receptor expressed in Sf9 cells


Bioorg Med Chem Lett 17: 925-31 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.058
BindingDB Entry DOI: 10.7270/Q2DB81HZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50201283
PNG
(3-((2-cyclohexylethylamino)methyl)-N,N-dimethyl-3,...)
Show SMILES CN(C)C1(CNCCC2CCCCC2)COc2ccccc2OC1
Show InChI InChI=1S/C20H32N2O2/c1-22(2)20(14-21-13-12-17-8-4-3-5-9-17)15-23-18-10-6-7-11-19(18)24-16-20/h6-7,10-11,17,21H,3-5,8-9,12-16H2,1-2H3
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6.20n/an/an/an/an/an/an/an/a



Mitsubishi Pharma Corporation

Curated by ChEMBL


Assay Description
Displacement of 1-[N-methyl- 3H]scopolamine from human muscarinic M2 receptor expressed in Sf9 cells


Bioorg Med Chem Lett 17: 925-31 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.058
BindingDB Entry DOI: 10.7270/Q2DB81HZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50201285
PNG
(3-((2-cycloheptylethylamino)methyl)-N,N-dimethyl-3...)
Show SMILES CN(C)C1(CNCCC2CCCCCC2)COc2ccccc2OC1
Show InChI InChI=1S/C21H34N2O2/c1-23(2)21(15-22-14-13-18-9-5-3-4-6-10-18)16-24-19-11-7-8-12-20(19)25-17-21/h7-8,11-12,18,22H,3-6,9-10,13-17H2,1-2H3
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12n/an/an/an/an/an/an/an/a



Mitsubishi Pharma Corporation

Curated by ChEMBL


Assay Description
Displacement of 1-[N-methyl- 3H]scopolamine from human muscarinic M1 receptor expressed in Sf9 cells


Bioorg Med Chem Lett 17: 925-31 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.058
BindingDB Entry DOI: 10.7270/Q2DB81HZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50201283
PNG
(3-((2-cyclohexylethylamino)methyl)-N,N-dimethyl-3,...)
Show SMILES CN(C)C1(CNCCC2CCCCC2)COc2ccccc2OC1
Show InChI InChI=1S/C20H32N2O2/c1-22(2)20(14-21-13-12-17-8-4-3-5-9-17)15-23-18-10-6-7-11-19(18)24-16-20/h6-7,10-11,17,21H,3-5,8-9,12-16H2,1-2H3
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18n/an/an/an/an/an/an/an/a



Mitsubishi Pharma Corporation

Curated by ChEMBL


Assay Description
Displacement of 1-[N-methyl- 3H]scopolamine from human muscarinic M1 receptor expressed in Sf9 cells


Bioorg Med Chem Lett 17: 925-31 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.058
BindingDB Entry DOI: 10.7270/Q2DB81HZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50201294
PNG
(3-((2-cyclopentylethylamino)methyl)-N,N-dimethyl-3...)
Show SMILES CN(C)C1(CNCCC2CCCC2)COc2ccccc2OC1
Show InChI InChI=1S/C19H30N2O2/c1-21(2)19(13-20-12-11-16-7-3-4-8-16)14-22-17-9-5-6-10-18(17)23-15-19/h5-6,9-10,16,20H,3-4,7-8,11-15H2,1-2H3
UniProtKB/SwissProt

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21n/an/an/an/an/an/an/an/a



Mitsubishi Pharma Corporation

Curated by ChEMBL


Assay Description
Displacement of 1-[N-methyl- 3H]scopolamine from human muscarinic M1 receptor expressed in Sf9 cells


Bioorg Med Chem Lett 17: 925-31 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.058
BindingDB Entry DOI: 10.7270/Q2DB81HZ
More data for this
Ligand-Target Pair