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PubMed code 23099092

Compile data set for download or QSAR
Found 74 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
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))		BDBM50401890
PNG
(CHEMBL2206606)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(C)C23CC4CC(CC(C4)C2)C3)cc1 |r,TLB:28:31:34:38.37.36,THB:32:33:36:40.31.39,32:31:34.33.38:36,39:31:34:38.37.36,39:37:34:40.32.31|
Show InChI InChI=1S/C34H46N4O5/c1-22(2)43-32(41)27-7-9-28(10-8-27)36-33(42)37-30(18-23-5-11-29(39)12-6-23)31(40)35-13-14-38(3,4)34-19-24-15-25(20-34)17-26(16-24)21-34/h5-12,22,24-26,30H,13-21H2,1-4H3,(H3-,35,36,37,39,40,41,42)/p+1/t24?,25?,26?,30-,34?/m0/s1
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n/an/a 6.10n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))		BDBM50401881
PNG
(CHEMBL2206587)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CC[N+](C)(Cc3ccc4OCOc4c3)CC2)cc1 |r|
Show InChI InChI=1S/C33H38N4O7/c1-22(2)44-32(40)25-7-9-26(10-8-25)34-33(41)35-28(18-23-4-11-27(38)12-5-23)31(39)36-14-16-37(3,17-15-36)20-24-6-13-29-30(19-24)43-21-42-29/h4-13,19,22,28H,14-18,20-21H2,1-3H3,(H2-,34,35,38,40,41)/p+1/t28-/m0/s1
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n/an/a 10.2n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401890
PNG
(CHEMBL2206606)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(C)C23CC4CC(CC(C4)C2)C3)cc1 |r,TLB:28:31:34:38.37.36,THB:32:33:36:40.31.39,32:31:34.33.38:36,39:31:34:38.37.36,39:37:34:40.32.31|
Show InChI InChI=1S/C34H46N4O5/c1-22(2)43-32(41)27-7-9-28(10-8-27)36-33(42)37-30(18-23-5-11-29(39)12-6-23)31(40)35-13-14-38(3,4)34-19-24-15-25(20-34)17-26(16-24)21-34/h5-12,22,24-26,30H,13-21H2,1-4H3,(H3-,35,36,37,39,40,41,42)/p+1/t24?,25?,26?,30-,34?/m0/s1
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n/an/a 13.1n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401890
PNG
(CHEMBL2206606)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(C)C23CC4CC(CC(C4)C2)C3)cc1 |r,TLB:28:31:34:38.37.36,THB:32:33:36:40.31.39,32:31:34.33.38:36,39:31:34:38.37.36,39:37:34:40.32.31|
Show InChI InChI=1S/C34H46N4O5/c1-22(2)43-32(41)27-7-9-28(10-8-27)36-33(42)37-30(18-23-5-11-29(39)12-6-23)31(40)35-13-14-38(3,4)34-19-24-15-25(20-34)17-26(16-24)21-34/h5-12,22,24-26,30H,13-21H2,1-4H3,(H3-,35,36,37,39,40,41,42)/p+1/t24?,25?,26?,30-,34?/m0/s1
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n/an/a 13.1n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))		BDBM50401898
PNG
(CHEMBL2207177)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CCC[C@H](C2)[N+](C)(C)Cc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C34H41ClN4O5/c1-23(2)44-33(42)26-11-15-28(16-12-26)36-34(43)37-31(20-24-9-17-30(40)18-10-24)32(41)38-19-5-6-29(21-38)39(3,4)22-25-7-13-27(35)14-8-25/h7-18,23,29,31H,5-6,19-22H2,1-4H3,(H2-,36,37,40,42,43)/p+1/t29-,31+/m1/s1
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n/an/a 13.3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401891
PNG
(CHEMBL2206605)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(Cc2ccc3ccccc3c2)Cc2ccc3ccccc3c2)cc1 |r|
Show InChI InChI=1S/C45H46N4O5/c1-31(2)54-44(52)37-18-20-40(21-19-37)47-45(53)48-42(28-32-14-22-41(50)23-15-32)43(51)46-24-25-49(3,29-33-12-16-35-8-4-6-10-38(35)26-33)30-34-13-17-36-9-5-7-11-39(36)27-34/h4-23,26-27,31,42H,24-25,28-30H2,1-3H3,(H3-,46,47,48,50,51,52,53)/p+1/t42-/m0/s1
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n/an/a 15n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))		BDBM50401879
PNG
(CHEMBL2206589)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CC[N+](Cc3ccc(Cl)cc3)(CC2)C(C)C)cc1 |r|
Show InChI InChI=1S/C34H41ClN4O5/c1-23(2)39(22-26-5-11-28(35)12-6-26)19-17-38(18-20-39)32(41)31(21-25-7-15-30(40)16-8-25)37-34(43)36-29-13-9-27(10-14-29)33(42)44-24(3)4/h5-16,23-24,31H,17-22H2,1-4H3,(H2-,36,37,40,42,43)/p+1/t31-/m0/s1
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n/an/a 27.5n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))		BDBM50401888
PNG
(CHEMBL2206608)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+]2(Cc3ccc(Cl)cc3)CCCCC2)cc1 |r|
Show InChI InChI=1S/C34H41ClN4O5/c1-24(2)44-33(42)27-10-14-29(15-11-27)37-34(43)38-31(22-25-8-16-30(40)17-9-25)32(41)36-18-21-39(19-4-3-5-20-39)23-26-6-12-28(35)13-7-26/h6-17,24,31H,3-5,18-23H2,1-2H3,(H3-,36,37,38,40,41,42,43)/p+1/t31-/m0/s1
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n/an/a 33.4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401877
PNG
(CHEMBL2206591)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CC[N+](CC3CCc4ccccc4C3)(Cc3ccc(Cl)cc3)CC2)cc1 |r|
Show InChI InChI=1S/C42H47ClN4O5/c1-29(2)52-41(50)34-13-17-37(18-14-34)44-42(51)45-39(26-30-10-19-38(48)20-11-30)40(49)46-21-23-47(24-22-46,27-31-8-15-36(43)16-9-31)28-32-7-12-33-5-3-4-6-35(33)25-32/h3-6,8-11,13-20,29,32,39H,7,12,21-28H2,1-2H3,(H2-,44,45,48,50,51)/p+1/t32?,39-/m0/s1
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n/an/a 41.2n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))		BDBM50401889
PNG
(CHEMBL2206607)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+]2(Cc3ccc(Cl)cc3)CCCC2)cc1 |r|
Show InChI InChI=1S/C33H39ClN4O5/c1-23(2)43-32(41)26-9-13-28(14-10-26)36-33(42)37-30(21-24-7-15-29(39)16-8-24)31(40)35-17-20-38(18-3-4-19-38)22-25-5-11-27(34)12-6-25/h5-16,23,30H,3-4,17-22H2,1-2H3,(H3-,35,36,37,39,40,41,42)/p+1/t30-/m0/s1
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n/an/a 44.9n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))		BDBM50401897
PNG
(CHEMBL2206599)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CCC[C@@H](C2)[N+](C)(C)Cc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C34H41ClN4O5/c1-23(2)44-33(42)26-11-15-28(16-12-26)36-34(43)37-31(20-24-9-17-30(40)18-10-24)32(41)38-19-5-6-29(21-38)39(3,4)22-25-7-13-27(35)14-8-25/h7-18,23,29,31H,5-6,19-22H2,1-4H3,(H2-,36,37,40,42,43)/p+1/t29-,31-/m0/s1
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n/an/a 45.3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))		BDBM50401880
PNG
(CHEMBL2206588)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CC[N+](C)(CC3CCCCC3)CC2)cc1 |r|
Show InChI InChI=1S/C32H44N4O5/c1-23(2)41-31(39)26-11-13-27(14-12-26)33-32(40)34-29(21-24-9-15-28(37)16-10-24)30(38)35-17-19-36(3,20-18-35)22-25-7-5-4-6-8-25/h9-16,23,25,29H,4-8,17-22H2,1-3H3,(H2-,33,34,37,39,40)/p+1/t29-/m0/s1
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n/an/a 50.2n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))		BDBM50401873
PNG
(CHEMBL2206595)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCc2n(Cc3ccc(Cl)cc3)cc[n+]2Cc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C38H37Cl2N5O5/c1-25(2)50-37(48)29-9-15-32(16-10-29)42-38(49)43-34(21-26-7-17-33(46)18-8-26)36(47)41-22-35-44(23-27-3-11-30(39)12-4-27)19-20-45(35)24-28-5-13-31(40)14-6-28/h3-20,25,34H,21-24H2,1-2H3,(H3-,41,42,43,46,47,48,49)/p+1/t34-/m0/s1
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n/an/a 51.9n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401878
PNG
(CHEMBL2206590)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CC[N+](CC3CCCCC3)(Cc3ccc(Cl)cc3)CC2)cc1 |r|
Show InChI InChI=1S/C38H47ClN4O5/c1-27(2)48-37(46)31-12-16-33(17-13-31)40-38(47)41-35(24-28-10-18-34(44)19-11-28)36(45)42-20-22-43(23-21-42,25-29-6-4-3-5-7-29)26-30-8-14-32(39)15-9-30/h8-19,27,29,35H,3-7,20-26H2,1-2H3,(H2-,40,41,44,46,47)/p+1/t35-/m0/s1
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n/an/a 58.8n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))		BDBM50401896
PNG
(CHEMBL2206600)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CCC(CC2)[N+]2(Cc3ccc(Cl)cc3)CCCC2)cc1 |r|
Show InChI InChI=1S/C36H43ClN4O5/c1-25(2)46-35(44)28-9-13-30(14-10-28)38-36(45)39-33(23-26-7-15-32(42)16-8-26)34(43)40-19-17-31(18-20-40)41(21-3-4-22-41)24-27-5-11-29(37)12-6-27/h5-16,25,31,33H,3-4,17-24H2,1-2H3,(H2-,38,39,42,44,45)/p+1/t33-/m0/s1
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n/an/a 68.9n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))		BDBM50401894
PNG
(CHEMBL2206602)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(Cc2ccc(Cl)cc2)Cc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C37H40Cl2N4O5/c1-25(2)48-36(46)29-10-16-32(17-11-29)41-37(47)42-34(22-26-8-18-33(44)19-9-26)35(45)40-20-21-43(3,23-27-4-12-30(38)13-5-27)24-28-6-14-31(39)15-7-28/h4-19,25,34H,20-24H2,1-3H3,(H3-,40,41,42,44,45,46,47)/p+1/t34-/m0/s1
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n/an/a 70.4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))		BDBM50401891
PNG
(CHEMBL2206605)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(Cc2ccc3ccccc3c2)Cc2ccc3ccccc3c2)cc1 |r|
Show InChI InChI=1S/C45H46N4O5/c1-31(2)54-44(52)37-18-20-40(21-19-37)47-45(53)48-42(28-32-14-22-41(50)23-15-32)43(51)46-24-25-49(3,29-33-12-16-35-8-4-6-10-38(35)26-33)30-34-13-17-36-9-5-7-11-39(36)27-34/h4-23,26-27,31,42H,24-25,28-30H2,1-3H3,(H3-,46,47,48,50,51,52,53)/p+1/t42-/m0/s1
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n/an/a 82.2n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401888
PNG
(CHEMBL2206608)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+]2(Cc3ccc(Cl)cc3)CCCCC2)cc1 |r|
Show InChI InChI=1S/C34H41ClN4O5/c1-24(2)44-33(42)27-10-14-29(15-11-27)37-34(43)38-31(22-25-8-16-30(40)17-9-25)32(41)36-18-21-39(19-4-3-5-20-39)23-26-6-12-28(35)13-7-26/h6-17,24,31H,3-5,18-23H2,1-2H3,(H3-,36,37,38,40,41,42,43)/p+1/t31-/m0/s1
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n/an/a 82.5n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401882
PNG
(CHEMBL2206586)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC(C)(C)C[N+](C)(C)Cc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C34H43ClN4O5/c1-23(2)44-32(42)26-11-15-28(16-12-26)37-33(43)38-30(19-24-9-17-29(40)18-10-24)31(41)36-21-34(3,4)22-39(5,6)20-25-7-13-27(35)14-8-25/h7-18,23,30H,19-22H2,1-6H3,(H3-,36,37,38,40,41,42,43)/p+1/t30-/m0/s1
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n/an/a 87.6n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401896
PNG
(CHEMBL2206600)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CCC(CC2)[N+]2(Cc3ccc(Cl)cc3)CCCC2)cc1 |r|
Show InChI InChI=1S/C36H43ClN4O5/c1-25(2)46-35(44)28-9-13-30(14-10-28)38-36(45)39-33(23-26-7-15-32(42)16-8-26)34(43)40-19-17-31(18-20-40)41(21-3-4-22-41)24-27-5-11-29(37)12-6-27/h5-16,25,31,33H,3-4,17-24H2,1-2H3,(H2-,38,39,42,44,45)/p+1/t33-/m0/s1
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n/an/a 94.6n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401879
PNG
(CHEMBL2206589)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CC[N+](Cc3ccc(Cl)cc3)(CC2)C(C)C)cc1 |r|
Show InChI InChI=1S/C34H41ClN4O5/c1-23(2)39(22-26-5-11-28(35)12-6-26)19-17-38(18-20-39)32(41)31(21-25-7-15-30(40)16-8-25)37-34(43)36-29-13-9-27(10-14-29)33(42)44-24(3)4/h5-16,23-24,31H,17-22H2,1-4H3,(H2-,36,37,40,42,43)/p+1/t31-/m0/s1
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n/an/a 97.9n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401897
PNG
(CHEMBL2206599)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CCC[C@@H](C2)[N+](C)(C)Cc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C34H41ClN4O5/c1-23(2)44-33(42)26-11-15-28(16-12-26)36-34(43)37-31(20-24-9-17-30(40)18-10-24)32(41)38-19-5-6-29(21-38)39(3,4)22-25-7-13-27(35)14-8-25/h7-18,23,29,31H,5-6,19-22H2,1-4H3,(H2-,36,37,40,42,43)/p+1/t29-,31-/m0/s1
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n/an/a 105n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401889
PNG
(CHEMBL2206607)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+]2(Cc3ccc(Cl)cc3)CCCC2)cc1 |r|
Show InChI InChI=1S/C33H39ClN4O5/c1-23(2)43-32(41)26-9-13-28(14-10-26)36-33(42)37-30(21-24-7-15-29(39)16-8-24)31(40)35-17-20-38(18-3-4-19-38)22-25-5-11-27(34)12-6-25/h5-16,23,30H,3-4,17-22H2,1-2H3,(H3-,35,36,37,39,40,41,42)/p+1/t30-/m0/s1
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n/an/a 108n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401878
PNG
(CHEMBL2206590)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CC[N+](CC3CCCCC3)(Cc3ccc(Cl)cc3)CC2)cc1 |r|
Show InChI InChI=1S/C38H47ClN4O5/c1-27(2)48-37(46)31-12-16-33(17-13-31)40-38(47)41-35(24-28-10-18-34(44)19-11-28)36(45)42-20-22-43(23-21-42,25-29-6-4-3-5-7-29)26-30-8-14-32(39)15-9-30/h8-19,27,29,35H,3-7,20-26H2,1-2H3,(H2-,40,41,44,46,47)/p+1/t35-/m0/s1
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n/an/a 141n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))		BDBM50401893
PNG
(CHEMBL2206603)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(C)Cc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C31H37ClN4O5/c1-21(2)41-30(39)24-9-13-26(14-10-24)34-31(40)35-28(19-22-7-15-27(37)16-8-22)29(38)33-17-18-36(3,4)20-23-5-11-25(32)12-6-23/h5-16,21,28H,17-20H2,1-4H3,(H3-,33,34,35,37,38,39,40)/p+1/t28-/m0/s1
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n/an/a 143n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))		BDBM50401887
PNG
(CHEMBL2206609)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+]2(C)CCCCCC2)cc1 |r|
Show InChI InChI=1S/C29H40N4O5/c1-21(2)38-28(36)23-10-12-24(13-11-23)31-29(37)32-26(20-22-8-14-25(34)15-9-22)27(35)30-16-19-33(3)17-6-4-5-7-18-33/h8-15,21,26H,4-7,16-20H2,1-3H3,(H3-,30,31,32,34,35,36,37)/p+1/t26-/m0/s1
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n/an/a 159n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401883
PNG
(CHEMBL2206585)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCCC[N+](C)(C)Cc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C32H39ClN4O5/c1-22(2)42-31(40)25-10-14-27(15-11-25)35-32(41)36-29(20-23-8-16-28(38)17-9-23)30(39)34-18-5-19-37(3,4)21-24-6-12-26(33)13-7-24/h6-17,22,29H,5,18-21H2,1-4H3,(H3-,34,35,36,38,39,40,41)/p+1/t29-/m0/s1
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n/an/a 179n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401873
PNG
(CHEMBL2206595)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCc2n(Cc3ccc(Cl)cc3)cc[n+]2Cc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C38H37Cl2N5O5/c1-25(2)50-37(48)29-9-15-32(16-10-29)42-38(49)43-34(21-26-7-17-33(46)18-8-26)36(47)41-22-35-44(23-27-3-11-30(39)12-4-27)19-20-45(35)24-28-5-13-31(40)14-6-28/h3-20,25,34H,21-24H2,1-2H3,(H3-,41,42,43,46,47,48,49)/p+1/t34-/m0/s1
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n/an/a 181n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401880
PNG
(CHEMBL2206588)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CC[N+](C)(CC3CCCCC3)CC2)cc1 |r|
Show InChI InChI=1S/C32H44N4O5/c1-23(2)41-31(39)26-11-13-27(14-12-26)33-32(40)34-29(21-24-9-15-28(37)16-10-24)30(38)35-17-19-36(3,20-18-35)22-25-7-5-4-6-8-25/h9-16,23,25,29H,4-8,17-22H2,1-3H3,(H2-,33,34,37,39,40)/p+1/t29-/m0/s1
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n/an/a 191n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))		BDBM50401883
PNG
(CHEMBL2206585)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCCC[N+](C)(C)Cc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C32H39ClN4O5/c1-22(2)42-31(40)25-10-14-27(15-11-25)35-32(41)36-29(20-23-8-16-28(38)17-9-23)30(39)34-18-5-19-37(3,4)21-24-6-12-26(33)13-7-24/h6-17,22,29H,5,18-21H2,1-4H3,(H3-,34,35,36,38,39,40,41)/p+1/t29-/m0/s1
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n/an/a 197n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401888
PNG
(CHEMBL2206608)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+]2(Cc3ccc(Cl)cc3)CCCCC2)cc1 |r|
Show InChI InChI=1S/C34H41ClN4O5/c1-24(2)44-33(42)27-10-14-29(15-11-27)37-34(43)38-31(22-25-8-16-30(40)17-9-25)32(41)36-18-21-39(19-4-3-5-20-39)23-26-6-12-28(35)13-7-26/h6-17,24,31H,3-5,18-23H2,1-2H3,(H3-,36,37,38,40,41,42,43)/p+1/t31-/m0/s1
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n/an/a 199n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))		BDBM50401892
PNG
(CHEMBL2206604)
Show SMILES CC[N+](CC)(CCNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)Nc1ccc(cc1)C(=O)OC(C)C)Cc1ccc(Cl)cc1 |r|
Show InChI InChI=1S/C33H41ClN4O5/c1-5-38(6-2,22-25-7-13-27(34)14-8-25)20-19-35-31(40)30(21-24-9-17-29(39)18-10-24)37-33(42)36-28-15-11-26(12-16-28)32(41)43-23(3)4/h7-18,23,30H,5-6,19-22H2,1-4H3,(H3-,35,36,37,39,40,41,42)/p+1/t30-/m0/s1
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GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))		BDBM50401886
PNG
(CHEMBL2206610)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(C(C)C)C(C)C)cc1 |r|
Show InChI InChI=1S/C29H42N4O5/c1-19(2)33(7,20(3)4)17-16-30-27(35)26(18-22-8-14-25(34)15-9-22)32-29(37)31-24-12-10-23(11-13-24)28(36)38-21(5)6/h8-15,19-21,26H,16-18H2,1-7H3,(H3-,30,31,32,34,35,36,37)/p+1/t26-/m0/s1
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GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401892
PNG
(CHEMBL2206604)
Show SMILES CC[N+](CC)(CCNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)Nc1ccc(cc1)C(=O)OC(C)C)Cc1ccc(Cl)cc1 |r|
Show InChI InChI=1S/C33H41ClN4O5/c1-5-38(6-2,22-25-7-13-27(34)14-8-25)20-19-35-31(40)30(21-24-9-17-29(39)18-10-24)37-33(42)36-28-15-11-26(12-16-28)32(41)43-23(3)4/h7-18,23,30H,5-6,19-22H2,1-4H3,(H3-,35,36,37,39,40,41,42)/p+1/t30-/m0/s1
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GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401873
PNG
(CHEMBL2206595)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCc2n(Cc3ccc(Cl)cc3)cc[n+]2Cc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C38H37Cl2N5O5/c1-25(2)50-37(48)29-9-15-32(16-10-29)42-38(49)43-34(21-26-7-17-33(46)18-8-26)36(47)41-22-35-44(23-27-3-11-30(39)12-4-27)19-20-45(35)24-28-5-13-31(40)14-6-28/h3-20,25,34H,21-24H2,1-2H3,(H3-,41,42,43,46,47,48,49)/p+1/t34-/m0/s1
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n/an/a 327n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401887
PNG
(CHEMBL2206609)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+]2(C)CCCCCC2)cc1 |r|
Show InChI InChI=1S/C29H40N4O5/c1-21(2)38-28(36)23-10-12-24(13-11-23)31-29(37)32-26(20-22-8-14-25(34)15-9-22)27(35)30-16-19-33(3)17-6-4-5-7-18-33/h8-15,21,26H,4-7,16-20H2,1-3H3,(H3-,30,31,32,34,35,36,37)/p+1/t26-/m0/s1
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n/an/a 328n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401886
PNG
(CHEMBL2206610)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(C(C)C)C(C)C)cc1 |r|
Show InChI InChI=1S/C29H42N4O5/c1-19(2)33(7,20(3)4)17-16-30-27(35)26(18-22-8-14-25(34)15-9-22)32-29(37)31-24-12-10-23(11-13-24)28(36)38-21(5)6/h8-15,19-21,26H,16-18H2,1-7H3,(H3-,30,31,32,34,35,36,37)/p+1/t26-/m0/s1
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GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401894
PNG
(CHEMBL2206602)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(Cc2ccc(Cl)cc2)Cc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C37H40Cl2N4O5/c1-25(2)48-36(46)29-10-16-32(17-11-29)41-37(47)42-34(22-26-8-18-33(44)19-9-26)35(45)40-20-21-43(3,23-27-4-12-30(38)13-5-27)24-28-6-14-31(39)15-7-28/h4-19,25,34H,20-24H2,1-3H3,(H3-,40,41,42,44,45,46,47)/p+1/t34-/m0/s1
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n/an/a 379n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))		BDBM50401874
PNG
(CHEMBL2206594)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N(C)Cc2n(C)cc[n+]2Cc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C33H36ClN5O5/c1-22(2)44-32(42)25-9-13-27(14-10-25)35-33(43)36-29(19-23-7-15-28(40)16-8-23)31(41)38(4)21-30-37(3)17-18-39(30)20-24-5-11-26(34)12-6-24/h5-18,22,29H,19-21H2,1-4H3,(H2-,35,36,40,42,43)/p+1/t29-/m0/s1
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GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401894
PNG
(CHEMBL2206602)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(Cc2ccc(Cl)cc2)Cc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C37H40Cl2N4O5/c1-25(2)48-36(46)29-10-16-32(17-11-29)41-37(47)42-34(22-26-8-18-33(44)19-9-26)35(45)40-20-21-43(3,23-27-4-12-30(38)13-5-27)24-28-6-14-31(39)15-7-28/h4-19,25,34H,20-24H2,1-3H3,(H3-,40,41,42,44,45,46,47)/p+1/t34-/m0/s1
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n/an/a 405n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401884
PNG
(CHEMBL2207176)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCCC[N+](C)(C)Cc2ccc3ccccc3c2)cc1 |r|
Show InChI InChI=1S/C36H42N4O5/c1-25(2)45-35(43)29-14-16-31(17-15-29)38-36(44)39-33(23-26-11-18-32(41)19-12-26)34(42)37-20-7-21-40(3,4)24-27-10-13-28-8-5-6-9-30(28)22-27/h5-6,8-19,22,25,33H,7,20-21,23-24H2,1-4H3,(H3-,37,38,39,41,42,43,44)/p+1/t33-/m0/s1
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n/an/a 411n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))		BDBM50401884
PNG
(CHEMBL2207176)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCCC[N+](C)(C)Cc2ccc3ccccc3c2)cc1 |r|
Show InChI InChI=1S/C36H42N4O5/c1-25(2)45-35(43)29-14-16-31(17-15-29)38-36(44)39-33(23-26-11-18-32(41)19-12-26)34(42)37-20-7-21-40(3,4)24-27-10-13-28-8-5-6-9-30(28)22-27/h5-6,8-19,22,25,33H,7,20-21,23-24H2,1-4H3,(H3-,37,38,39,41,42,43,44)/p+1/t33-/m0/s1
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GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401889
PNG
(CHEMBL2206607)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+]2(Cc3ccc(Cl)cc3)CCCC2)cc1 |r|
Show InChI InChI=1S/C33H39ClN4O5/c1-23(2)43-32(41)26-9-13-28(14-10-26)36-33(42)37-30(21-24-7-15-29(39)16-8-24)31(40)35-17-20-38(18-3-4-19-38)22-25-5-11-27(34)12-6-25/h5-16,23,30H,3-4,17-22H2,1-2H3,(H3-,35,36,37,39,40,41,42)/p+1/t30-/m0/s1
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n/an/a 418n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401881
PNG
(CHEMBL2206587)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CC[N+](C)(Cc3ccc4OCOc4c3)CC2)cc1 |r|
Show InChI InChI=1S/C33H38N4O7/c1-22(2)44-32(40)25-7-9-26(10-8-25)34-33(41)35-28(18-23-4-11-27(38)12-5-23)31(39)36-14-16-37(3,17-15-36)20-24-6-13-29-30(19-24)43-21-42-29/h4-13,19,22,28H,14-18,20-21H2,1-3H3,(H2-,34,35,38,40,41)/p+1/t28-/m0/s1
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n/an/a 427n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401877
PNG
(CHEMBL2206591)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CC[N+](CC3CCc4ccccc4C3)(Cc3ccc(Cl)cc3)CC2)cc1 |r|
Show InChI InChI=1S/C42H47ClN4O5/c1-29(2)52-41(50)34-13-17-37(18-14-34)44-42(51)45-39(26-30-10-19-38(48)20-11-30)40(49)46-21-23-47(24-22-46,27-31-8-15-36(43)16-9-31)28-32-7-12-33-5-3-4-6-35(33)25-32/h3-6,8-11,13-20,29,32,39H,7,12,21-28H2,1-2H3,(H2-,44,45,48,50,51)/p+1/t32?,39-/m0/s1
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GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401882
PNG
(CHEMBL2206586)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC(C)(C)C[N+](C)(C)Cc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C34H43ClN4O5/c1-23(2)44-32(42)26-11-15-28(16-12-26)37-33(43)38-30(19-24-9-17-29(40)18-10-24)31(41)36-21-34(3,4)22-39(5,6)20-25-7-13-27(35)14-8-25/h7-18,23,30H,19-22H2,1-6H3,(H3-,36,37,38,40,41,42,43)/p+1/t30-/m0/s1
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GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401893
PNG
(CHEMBL2206603)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(C)Cc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C31H37ClN4O5/c1-21(2)41-30(39)24-9-13-26(14-10-24)34-31(40)35-28(19-22-7-15-27(37)16-8-22)29(38)33-17-18-36(3,4)20-23-5-11-25(32)12-6-23/h5-16,21,28H,17-20H2,1-4H3,(H3-,33,34,35,37,38,39,40)/p+1/t28-/m0/s1
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GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401895
PNG
(CHEMBL2206601)
Show SMILES CC[N+]1(CCCC1)C1CCN(CC1)C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)Nc1ccc(cc1)C(=O)OC(C)C |r|
Show InChI InChI=1S/C31H42N4O5/c1-4-35(19-5-6-20-35)26-15-17-34(18-16-26)29(37)28(21-23-7-13-27(36)14-8-23)33-31(39)32-25-11-9-24(10-12-25)30(38)40-22(2)3/h7-14,22,26,28H,4-6,15-21H2,1-3H3,(H2-,32,33,36,38,39)/p+1/t28-/m0/s1
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n/an/a 556n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))		BDBM50401895
PNG
(CHEMBL2206601)
Show SMILES CC[N+]1(CCCC1)C1CCN(CC1)C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)Nc1ccc(cc1)C(=O)OC(C)C |r|
Show InChI InChI=1S/C31H42N4O5/c1-4-35(19-5-6-20-35)26-15-17-34(18-16-26)29(37)28(21-23-7-13-27(36)14-8-23)33-31(39)32-25-11-9-24(10-12-25)30(38)40-22(2)3/h7-14,22,26,28H,4-6,15-21H2,1-3H3,(H2-,32,33,36,38,39)/p+1/t28-/m0/s1
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n/an/a 579n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401892
PNG
(CHEMBL2206604)
Show SMILES CC[N+](CC)(CCNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)Nc1ccc(cc1)C(=O)OC(C)C)Cc1ccc(Cl)cc1 |r|
Show InChI InChI=1S/C33H41ClN4O5/c1-5-38(6-2,22-25-7-13-27(34)14-8-25)20-19-35-31(40)30(21-24-9-17-29(39)18-10-24)37-33(42)36-28-15-11-26(12-16-28)32(41)43-23(3)4/h7-18,23,30H,5-6,19-22H2,1-4H3,(H3-,35,36,37,39,40,41,42)/p+1/t30-/m0/s1
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n/an/a 584n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401884
PNG
(CHEMBL2207176)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCCC[N+](C)(C)Cc2ccc3ccccc3c2)cc1 |r|
Show InChI InChI=1S/C36H42N4O5/c1-25(2)45-35(43)29-14-16-31(17-15-29)38-36(44)39-33(23-26-11-18-32(41)19-12-26)34(42)37-20-7-21-40(3,4)24-27-10-13-28-8-5-6-9-30(28)22-27/h5-6,8-19,22,25,33H,7,20-21,23-24H2,1-4H3,(H3-,37,38,39,41,42,43,44)/p+1/t33-/m0/s1
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n/an/a 734n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401883
PNG
(CHEMBL2206585)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCCC[N+](C)(C)Cc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C32H39ClN4O5/c1-22(2)42-31(40)25-10-14-27(15-11-25)35-32(41)36-29(20-23-8-16-28(38)17-9-23)30(39)34-18-5-19-37(3,4)21-24-6-12-26(33)13-7-24/h6-17,22,29H,5,18-21H2,1-4H3,(H3-,34,35,36,38,39,40,41)/p+1/t29-/m0/s1
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n/an/a 757n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401898
PNG
(CHEMBL2207177)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CCC[C@H](C2)[N+](C)(C)Cc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C34H41ClN4O5/c1-23(2)44-33(42)26-11-15-28(16-12-26)36-34(43)37-31(20-24-9-17-30(40)18-10-24)32(41)38-19-5-6-29(21-38)39(3,4)22-25-7-13-27(35)14-8-25/h7-18,23,29,31H,5-6,19-22H2,1-4H3,(H2-,36,37,40,42,43)/p+1/t29-,31+/m1/s1
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n/an/a 832n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401876
PNG
(CHEMBL2206592)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CC[N+](C)(CCc3ccccc3)CC2)cc1 |r|
Show InChI InChI=1S/C33H40N4O5/c1-24(2)42-32(40)27-11-13-28(14-12-27)34-33(41)35-30(23-26-9-15-29(38)16-10-26)31(39)36-18-21-37(3,22-19-36)20-17-25-7-5-4-6-8-25/h4-16,24,30H,17-23H2,1-3H3,(H2-,34,35,38,40,41)/p+1/t30-/m0/s1
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n/an/a 860n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401896
PNG
(CHEMBL2206600)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CCC(CC2)[N+]2(Cc3ccc(Cl)cc3)CCCC2)cc1 |r|
Show InChI InChI=1S/C36H43ClN4O5/c1-25(2)46-35(44)28-9-13-30(14-10-28)38-36(45)39-33(23-26-7-15-32(42)16-8-26)34(43)40-19-17-31(18-20-40)41(21-3-4-22-41)24-27-5-11-29(37)12-6-27/h5-16,25,31,33H,3-4,17-24H2,1-2H3,(H2-,38,39,42,44,45)/p+1/t33-/m0/s1
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n/an/a 882n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401879
PNG
(CHEMBL2206589)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CC[N+](Cc3ccc(Cl)cc3)(CC2)C(C)C)cc1 |r|
Show InChI InChI=1S/C34H41ClN4O5/c1-23(2)39(22-26-5-11-28(35)12-6-26)19-17-38(18-20-39)32(41)31(21-25-7-15-30(40)16-8-25)37-34(43)36-29-13-9-27(10-14-29)33(42)44-24(3)4/h5-16,23-24,31H,17-22H2,1-4H3,(H2-,36,37,40,42,43)/p+1/t31-/m0/s1
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n/an/a 894n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401891
PNG
(CHEMBL2206605)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(Cc2ccc3ccccc3c2)Cc2ccc3ccccc3c2)cc1 |r|
Show InChI InChI=1S/C45H46N4O5/c1-31(2)54-44(52)37-18-20-40(21-19-37)47-45(53)48-42(28-32-14-22-41(50)23-15-32)43(51)46-24-25-49(3,29-33-12-16-35-8-4-6-10-38(35)26-33)30-34-13-17-36-9-5-7-11-39(36)27-34/h4-23,26-27,31,42H,24-25,28-30H2,1-3H3,(H3-,46,47,48,50,51,52,53)/p+1/t42-/m0/s1
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n/an/a 948n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401874
PNG
(CHEMBL2206594)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N(C)Cc2n(C)cc[n+]2Cc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C33H36ClN5O5/c1-22(2)44-32(42)25-9-13-27(14-10-25)35-33(43)36-29(19-23-7-15-28(40)16-8-23)31(41)38(4)21-30-37(3)17-18-39(30)20-24-5-11-26(34)12-6-24/h5-18,22,29H,19-21H2,1-4H3,(H2-,35,36,40,42,43)/p+1/t29-/m0/s1
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n/an/a 999n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401897
PNG
(CHEMBL2206599)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CCC[C@@H](C2)[N+](C)(C)Cc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C34H41ClN4O5/c1-23(2)44-33(42)26-11-15-28(16-12-26)36-34(43)37-31(20-24-9-17-30(40)18-10-24)32(41)38-19-5-6-29(21-38)39(3,4)22-25-7-13-27(35)14-8-25/h7-18,23,29,31H,5-6,19-22H2,1-4H3,(H2-,36,37,40,42,43)/p+1/t29-,31-/m0/s1
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n/an/a 1.12E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401876
PNG
(CHEMBL2206592)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CC[N+](C)(CCc3ccccc3)CC2)cc1 |r|
Show InChI InChI=1S/C33H40N4O5/c1-24(2)42-32(40)27-11-13-28(14-12-27)34-33(41)35-30(23-26-9-15-29(38)16-10-26)31(39)36-18-21-37(3,22-19-36)20-17-25-7-5-4-6-8-25/h4-16,24,30H,17-23H2,1-3H3,(H2-,34,35,38,40,41)/p+1/t30-/m0/s1
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n/an/a 1.35E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401893
PNG
(CHEMBL2206603)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(C)Cc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C31H37ClN4O5/c1-21(2)41-30(39)24-9-13-26(14-10-24)34-31(40)35-28(19-22-7-15-27(37)16-8-22)29(38)33-17-18-36(3,4)20-23-5-11-25(32)12-6-23/h5-16,21,28H,17-20H2,1-4H3,(H3-,33,34,35,37,38,39,40)/p+1/t28-/m0/s1
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n/an/a 1.43E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401898
PNG
(CHEMBL2207177)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CCC[C@H](C2)[N+](C)(C)Cc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C34H41ClN4O5/c1-23(2)44-33(42)26-11-15-28(16-12-26)36-34(43)37-31(20-24-9-17-30(40)18-10-24)32(41)38-19-5-6-29(21-38)39(3,4)22-25-7-13-27(35)14-8-25/h7-18,23,29,31H,5-6,19-22H2,1-4H3,(H2-,36,37,40,42,43)/p+1/t29-,31+/m1/s1
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n/an/a 1.90E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401880
PNG
(CHEMBL2206588)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CC[N+](C)(CC3CCCCC3)CC2)cc1 |r|
Show InChI InChI=1S/C32H44N4O5/c1-23(2)41-31(39)26-11-13-27(14-12-26)33-32(40)34-29(21-24-9-15-28(37)16-10-24)30(38)35-17-19-36(3,20-18-35)22-25-7-5-4-6-8-25/h9-16,23,25,29H,4-8,17-22H2,1-3H3,(H2-,33,34,37,39,40)/p+1/t29-/m0/s1
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n/an/a 2.50E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401886
PNG
(CHEMBL2206610)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+](C)(C(C)C)C(C)C)cc1 |r|
Show InChI InChI=1S/C29H42N4O5/c1-19(2)33(7,20(3)4)17-16-30-27(35)26(18-22-8-14-25(34)15-9-22)32-29(37)31-24-12-10-23(11-13-24)28(36)38-21(5)6/h8-15,19-21,26H,16-18H2,1-7H3,(H3-,30,31,32,34,35,36,37)/p+1/t26-/m0/s1
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n/an/a>3.30E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))		BDBM50401875
PNG
(CHEMBL2206593)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N(C)Cc2n(C)cc[n+]2C)cc1 |r|
Show InChI InChI=1S/C27H33N5O5/c1-18(2)37-26(35)20-8-10-21(11-9-20)28-27(36)29-23(16-19-6-12-22(33)13-7-19)25(34)32(5)17-24-30(3)14-15-31(24)4/h6-15,18,23H,16-17H2,1-5H3,(H2-,28,29,33,35,36)/p+1/t23-/m0/s1
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n/an/a>3.30E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401885
PNG
(CHEMBL2207175)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N(CC[N+](C)(C)C)Cc2ccccc2)cc1 |r|
Show InChI InChI=1S/C32H40N4O5/c1-23(2)41-31(39)26-13-15-27(16-14-26)33-32(40)34-29(21-24-11-17-28(37)18-12-24)30(38)35(19-20-36(3,4)5)22-25-9-7-6-8-10-25/h6-18,23,29H,19-22H2,1-5H3,(H2-,33,34,37,39,40)/p+1/t29-/m0/s1
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n/an/a>3.30E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401885
PNG
(CHEMBL2207175)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N(CC[N+](C)(C)C)Cc2ccccc2)cc1 |r|
Show InChI InChI=1S/C32H40N4O5/c1-23(2)41-31(39)26-13-15-27(16-14-26)33-32(40)34-29(21-24-11-17-28(37)18-12-24)30(38)35(19-20-36(3,4)5)22-25-9-7-6-8-10-25/h6-18,23,29H,19-22H2,1-5H3,(H2-,33,34,37,39,40)/p+1/t29-/m0/s1
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n/an/a>3.30E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))		BDBM50401875
PNG
(CHEMBL2206593)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N(C)Cc2n(C)cc[n+]2C)cc1 |r|
Show InChI InChI=1S/C27H33N5O5/c1-18(2)37-26(35)20-8-10-21(11-9-20)28-27(36)29-23(16-19-6-12-22(33)13-7-19)25(34)32(5)17-24-30(3)14-15-31(24)4/h6-15,18,23H,16-17H2,1-5H3,(H2-,28,29,33,35,36)/p+1/t23-/m0/s1
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n/an/a>3.30E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M2 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401887
PNG
(CHEMBL2206609)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NCC[N+]2(C)CCCCCC2)cc1 |r|
Show InChI InChI=1S/C29H40N4O5/c1-21(2)38-28(36)23-10-12-24(13-11-23)31-29(37)32-26(20-22-8-14-25(34)15-9-22)27(35)30-16-19-33(3)17-6-4-5-7-18-33/h8-15,21,26H,4-7,16-20H2,1-3H3,(H3-,30,31,32,34,35,36,37)/p+1/t26-/m0/s1
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n/an/a>3.30E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401895
PNG
(CHEMBL2206601)
Show SMILES CC[N+]1(CCCC1)C1CCN(CC1)C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)Nc1ccc(cc1)C(=O)OC(C)C |r|
Show InChI InChI=1S/C31H42N4O5/c1-4-35(19-5-6-20-35)26-15-17-34(18-16-26)29(37)28(21-23-7-13-27(36)14-8-23)33-31(39)32-25-11-9-24(10-12-25)30(38)40-22(2)3/h7-14,22,26,28H,4-6,15-21H2,1-3H3,(H2-,32,33,36,38,39)/p+1/t28-/m0/s1
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n/an/a>3.30E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))		BDBM50401885
PNG
(CHEMBL2207175)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N(CC[N+](C)(C)C)Cc2ccccc2)cc1 |r|
Show InChI InChI=1S/C32H40N4O5/c1-23(2)41-31(39)26-13-15-27(16-14-26)33-32(40)34-29(21-24-11-17-28(37)18-12-24)30(38)35(19-20-36(3,4)5)22-25-9-7-6-8-10-25/h6-18,23,29H,19-22H2,1-5H3,(H2-,33,34,37,39,40)/p+1/t29-/m0/s1
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n/an/a>3.30E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401881
PNG
(CHEMBL2206587)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CC[N+](C)(Cc3ccc4OCOc4c3)CC2)cc1 |r|
Show InChI InChI=1S/C33H38N4O7/c1-22(2)44-32(40)25-7-9-26(10-8-25)34-33(41)35-28(18-23-4-11-27(38)12-5-23)31(39)36-14-16-37(3,17-15-36)20-24-6-13-29-30(19-24)43-21-42-29/h4-13,19,22,28H,14-18,20-21H2,1-3H3,(H2-,34,35,38,40,41)/p+1/t28-/m0/s1
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n/an/a>3.30E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401874
PNG
(CHEMBL2206594)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N(C)Cc2n(C)cc[n+]2Cc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C33H36ClN5O5/c1-22(2)44-32(42)25-9-13-27(14-10-25)35-33(43)36-29(19-23-7-15-28(40)16-8-23)31(41)38(4)21-30-37(3)17-18-39(30)20-24-5-11-26(34)12-6-24/h5-18,22,29H,19-21H2,1-4H3,(H2-,35,36,40,42,43)/p+1/t29-/m0/s1
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n/an/a>3.30E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50401875
PNG
(CHEMBL2206593)
Show SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N(C)Cc2n(C)cc[n+]2C)cc1 |r|
Show InChI InChI=1S/C27H33N5O5/c1-18(2)37-26(35)20-8-10-21(11-9-20)28-27(36)29-23(16-19-6-12-22(33)13-7-19)25(34)32(5)17-24-30(3)14-15-31(24)4/h6-15,18,23H,16-17H2,1-5H3,(H2-,28,29,33,35,36)/p+1/t23-/m0/s1
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n/an/a>3.30E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human muscarinic M1 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FL...

Bioorg Med Chem Lett 22: 7087-91 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.085
BindingDB Entry DOI: 10.7270/Q2ZK5HT1
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%