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32 similar compounds to monomer 50181121

Compile data set for download or QSAR
Wt: 300.4
BDBM50181109
Wt: 300.4
BDBM50181114
Wt: 300.4
BDBM50181115
Wt: 362.5
BDBM50181117
Wt: 300.4
BDBM50181118
Wt: 286.4
BDBM50181119
Wt: 284.3
BDBM50181120
Wt: 326.4
BDBM50181122
Wt: 272.3
BDBM50181123
Wt: 286.3
BDBM50181126
Wt: 314.4
BDBM50181127
Wt: 288.4
BDBM50181128
Wt: 258.3
BDBM50181131
Wt: 340.3
BDBM50181133
Wt: 272.3
BDBM50181134
Displayed 1 to 15 (of 32 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 15 hits for monomerid = 50181109,50181114,50181115,50181117,50181118,50181119,50181120,50181122,50181123,50181126,50181127,50181128,50181131,50181133,50181134   
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 M3


(Homo sapiens (Human))
BDBM50181118
PNG
((+,-)-6-(azepan-1-yl)-2-cyclopropyl-5-methyl-N-(2-...)
Show SMILES C[C@H]1C[C@@H]1Nc1nc(nc(N2CCCCCC2)c1C)C1CC1
Show InChI InChI=1S/C18H28N4/c1-12-11-15(12)19-16-13(2)18(21-17(20-16)14-7-8-14)22-9-5-3-4-6-10-22/h12,14-15H,3-11H2,1-2H3,(H,19,20,21)/t12-,15-/m0/s1
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7.90n/an/an/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Displacement of [3H]methylscopolamine from recombinant human muscarinic M3 receptors expressed in CHO cells


Bioorg Med Chem Lett 16: 1834-9 (2006)


Article DOI: 10.1016/j.bmcl.2006.01.006
BindingDB Entry DOI: 10.7270/Q2TQ613B
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50181114
PNG
(6-(azepan-1-yl)-2-cyclopropyl-5-methyl-N-(1-methyl...)
Show SMILES Cc1c(NC2(C)CC2)nc(nc1N1CCCCCC1)C1CC1
Show InChI InChI=1S/C18H28N4/c1-13-15(21-18(2)9-10-18)19-16(14-7-8-14)20-17(13)22-11-5-3-4-6-12-22/h14H,3-12H2,1-2H3,(H,19,20,21)
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10n/an/an/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Displacement of [3H]methylscopolamine from recombinant human muscarinic M3 receptors expressed in CHO cells


Bioorg Med Chem Lett 16: 1834-9 (2006)


Article DOI: 10.1016/j.bmcl.2006.01.006
BindingDB Entry DOI: 10.7270/Q2TQ613B
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50181134
PNG
(CHEMBL205105 | N,2-dicyclopropyl-5-methyl-6-(piper...)
Show SMILES Cc1c(NC2CC2)nc(nc1N1CCCCC1)C1CC1
Show InChI InChI=1S/C16H24N4/c1-11-14(17-13-7-8-13)18-15(12-5-6-12)19-16(11)20-9-3-2-4-10-20/h12-13H,2-10H2,1H3,(H,17,18,19)
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13n/an/an/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Displacement of [3H]methylscopolamine from recombinant human muscarinic M3 receptors expressed in CHO cells


Bioorg Med Chem Lett 16: 1834-9 (2006)


Article DOI: 10.1016/j.bmcl.2006.01.006
BindingDB Entry DOI: 10.7270/Q2TQ613B
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50181128
PNG
(6-(azepan-1-yl)-N-cyclopropyl-2-isopropyl-5-methyl...)
Show SMILES CC(C)c1nc(NC2CC2)c(C)c(n1)N1CCCCCC1
Show InChI InChI=1S/C17H28N4/c1-12(2)15-19-16(18-14-8-9-14)13(3)17(20-15)21-10-6-4-5-7-11-21/h12,14H,4-11H2,1-3H3,(H,18,19,20)
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25n/an/an/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Displacement of [3H]methylscopolamine from recombinant human muscarinic M3 receptors expressed in CHO cells


Bioorg Med Chem Lett 16: 1834-9 (2006)


Article DOI: 10.1016/j.bmcl.2006.01.006
BindingDB Entry DOI: 10.7270/Q2TQ613B
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50181109
PNG
(CHEMBL205944 | N,2-dicyclopropyl-6-(4-ethylpiperid...)
Show SMILES CCC1CCN(CC1)c1nc(nc(NC2CC2)c1C)C1CC1
Show InChI InChI=1S/C18H28N4/c1-3-13-8-10-22(11-9-13)18-12(2)16(19-15-6-7-15)20-17(21-18)14-4-5-14/h13-15H,3-11H2,1-2H3,(H,19,20,21)
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50n/an/an/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Displacement of [3H]methylscopolamine from recombinant human muscarinic M3 receptors expressed in CHO cells


Bioorg Med Chem Lett 16: 1834-9 (2006)


Article DOI: 10.1016/j.bmcl.2006.01.006
BindingDB Entry DOI: 10.7270/Q2TQ613B
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50181123
PNG
(6-(azepan-1-yl)-N,2-dicyclopropylpyrimidin-4-amine...)
Show SMILES C1CC1Nc1cc(nc(n1)C1CC1)N1CCCCCC1
Show InChI InChI=1S/C16H24N4/c1-2-4-10-20(9-3-1)15-11-14(17-13-7-8-13)18-16(19-15)12-5-6-12/h11-13H,1-10H2,(H,17,18,19)
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63n/an/an/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Displacement of [3H]methylscopolamine from recombinant human muscarinic M3 receptors expressed in CHO cells


Bioorg Med Chem Lett 16: 1834-9 (2006)


Article DOI: 10.1016/j.bmcl.2006.01.006
BindingDB Entry DOI: 10.7270/Q2TQ613B
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50181120
PNG
(CHEMBL206480 | N,2-dicyclopropyl-5-methyl-6-(4-met...)
Show SMILES Cc1c(NC2CC2)nc(nc1N1CCC(=C)CC1)C1CC1
Show InChI InChI=1S/C17H24N4/c1-11-7-9-21(10-8-11)17-12(2)15(18-14-5-6-14)19-16(20-17)13-3-4-13/h13-14H,1,3-10H2,2H3,(H,18,19,20)
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79n/an/an/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Displacement of [3H]methylscopolamine from recombinant human muscarinic M3 receptors expressed in CHO cells


Bioorg Med Chem Lett 16: 1834-9 (2006)


Article DOI: 10.1016/j.bmcl.2006.01.006
BindingDB Entry DOI: 10.7270/Q2TQ613B
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50181127
PNG
(6-(azepan-1-yl)-2-cyclopentyl-N-cyclopropyl-5-meth...)
Show SMILES Cc1c(NC2CC2)nc(nc1N1CCCCCC1)C1CCCC1
Show InChI InChI=1S/C19H30N4/c1-14-17(20-16-10-11-16)21-18(15-8-4-5-9-15)22-19(14)23-12-6-2-3-7-13-23/h15-16H,2-13H2,1H3,(H,20,21,22)
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79n/an/an/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Displacement of [3H]methylscopolamine from recombinant human muscarinic M3 receptors expressed in CHO cells


Bioorg Med Chem Lett 16: 1834-9 (2006)


Article DOI: 10.1016/j.bmcl.2006.01.006
BindingDB Entry DOI: 10.7270/Q2TQ613B
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50181133
PNG
(CHEMBL380926 | N,2-dicyclopropyl-5-methyl-6-(4-(tr...)
Show SMILES Cc1c(NC2CC2)nc(nc1N1CCC(CC1)C(F)(F)F)C1CC1
Show InChI InChI=1S/C17H23F3N4/c1-10-14(21-13-4-5-13)22-15(11-2-3-11)23-16(10)24-8-6-12(7-9-24)17(18,19)20/h11-13H,2-9H2,1H3,(H,21,22,23)
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100n/an/an/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Displacement of [3H]methylscopolamine from recombinant human muscarinic M3 receptors expressed in CHO cells


Bioorg Med Chem Lett 16: 1834-9 (2006)


Article DOI: 10.1016/j.bmcl.2006.01.006
BindingDB Entry DOI: 10.7270/Q2TQ613B
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50181131
PNG
(CHEMBL427390 | N,2-dicyclopropyl-5-methyl-6-(pyrro...)
Show SMILES Cc1c(NC2CC2)nc(nc1N1CCCC1)C1CC1
Show InChI InChI=1S/C15H22N4/c1-10-13(16-12-6-7-12)17-14(11-4-5-11)18-15(10)19-8-2-3-9-19/h11-12H,2-9H2,1H3,(H,16,17,18)
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100n/an/an/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Displacement of [3H]methylscopolamine from recombinant human muscarinic M3 receptors expressed in CHO cells


Bioorg Med Chem Lett 16: 1834-9 (2006)


Article DOI: 10.1016/j.bmcl.2006.01.006
BindingDB Entry DOI: 10.7270/Q2TQ613B
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50181115
PNG
(6-(azepan-1-yl)-N-cyclopropyl-2-(cyclopropylmethyl...)
Show SMILES Cc1c(NC2CC2)nc(CC2CC2)nc1N1CCCCCC1
Show InChI InChI=1S/C18H28N4/c1-13-17(19-15-8-9-15)20-16(12-14-6-7-14)21-18(13)22-10-4-2-3-5-11-22/h14-15H,2-12H2,1H3,(H,19,20,21)
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126n/an/an/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Displacement of [3H]methylscopolamine from recombinant human muscarinic M3 receptors expressed in CHO cells


Bioorg Med Chem Lett 16: 1834-9 (2006)


Article DOI: 10.1016/j.bmcl.2006.01.006
BindingDB Entry DOI: 10.7270/Q2TQ613B
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50181122
PNG
(CHEMBL204353 | [6-(8-aza-spiro[4.5]dec-8-yl)-2-cyc...)
Show SMILES Cc1c(NC2CC2)nc(nc1N1CCC2(CCCC2)CC1)C1CC1
Show InChI InChI=1S/C20H30N4/c1-14-17(21-16-6-7-16)22-18(15-4-5-15)23-19(14)24-12-10-20(11-13-24)8-2-3-9-20/h15-16H,2-13H2,1H3,(H,21,22,23)
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158n/an/an/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Displacement of [3H]methylscopolamine from recombinant human muscarinic M3 receptors expressed in CHO cells


Bioorg Med Chem Lett 16: 1834-9 (2006)


Article DOI: 10.1016/j.bmcl.2006.01.006
BindingDB Entry DOI: 10.7270/Q2TQ613B
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50181119
PNG
(CHEMBL377728 | N4-cyclohexyl-N6,2-dicyclopropyl-5-...)
Show SMILES Cc1c(NC2CC2)nc(nc1NC1CCCCC1)C1CC1
Show InChI InChI=1S/C17H26N4/c1-11-15(18-13-5-3-2-4-6-13)20-17(12-7-8-12)21-16(11)19-14-9-10-14/h12-14H,2-10H2,1H3,(H2,18,19,20,21)
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316n/an/an/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Displacement of [3H]methylscopolamine from recombinant human muscarinic M3 receptors expressed in CHO cells


Bioorg Med Chem Lett 16: 1834-9 (2006)


Article DOI: 10.1016/j.bmcl.2006.01.006
BindingDB Entry DOI: 10.7270/Q2TQ613B
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50181117
PNG
(6-(4-benzylpiperidin-1-yl)-N,2-dicyclopropyl-5-met...)
Show SMILES Cc1c(NC2CC2)nc(nc1N1CCC(Cc2ccccc2)CC1)C1CC1
Show InChI InChI=1S/C23H30N4/c1-16-21(24-20-9-10-20)25-22(19-7-8-19)26-23(16)27-13-11-18(12-14-27)15-17-5-3-2-4-6-17/h2-6,18-20H,7-15H2,1H3,(H,24,25,26)
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790n/an/an/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Displacement of [3H]methylscopolamine from recombinant human muscarinic M3 receptors expressed in CHO cells


Bioorg Med Chem Lett 16: 1834-9 (2006)


Article DOI: 10.1016/j.bmcl.2006.01.006
BindingDB Entry DOI: 10.7270/Q2TQ613B
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50181126
PNG
(1-(2-cyclopropyl-6-(cyclopropylamino)-5-methylpyri...)
Show SMILES Cc1c(NC2CC2)nc(nc1N1CCC(=O)CC1)C1CC1
Show InChI InChI=1S/C16H22N4O/c1-10-14(17-12-4-5-12)18-15(11-2-3-11)19-16(10)20-8-6-13(21)7-9-20/h11-12H,2-9H2,1H3,(H,17,18,19)
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3.20E+3n/an/an/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Displacement of [3H]methylscopolamine from recombinant human muscarinic M3 receptors expressed in CHO cells


Bioorg Med Chem Lett 16: 1834-9 (2006)


Article DOI: 10.1016/j.bmcl.2006.01.006
BindingDB Entry DOI: 10.7270/Q2TQ613B
More data for this
Ligand-Target Pair