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10 similar compounds to monomer 50076085

Compile data set for download or QSAR
Wt: 362.5
BDBM50076078
Wt: 362.5
BDBM50076079
Wt: 348.5
BDBM50076081
Wt: 347.5
BDBM50076082
Wt: 361.5
BDBM50076084
Wt: 334.4
BDBM50076092
Wt: 347.5
BDBM50076094
Wt: 333.5
BDBM50076096
Wt: 416.6
BDBM50076098
Wt: 348.5
BDBM50076099

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 20 hits for monomerid = 50076078,50076079,50076081,50076082,50076084,50076092,50076094,50076096,50076098,50076099   
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))
BDBM50076092
PNG
((3S,3aR,4R,4aS,8aR,9aS)-3-Methyl-4-(3-piperazin-1-...)
Show SMILES C[C@@H]1OC(=O)[C@H]2C[C@H]3CCCC[C@@H]3[C@@H](CCCN3CCNCC3)[C@@H]12
Show InChI InChI=1S/C20H34N2O2/c1-14-19-17(7-4-10-22-11-8-21-9-12-22)16-6-3-2-5-15(16)13-18(19)20(23)24-14/h14-19,21H,2-13H2,1H3/t14-,15+,16-,17+,18-,19+/m0/s1
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>42n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards human muscarinic M2 receptor in CHO-KI cells using [3H]- QNB as radioligand


Bioorg Med Chem Lett 9: 901-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00101-8
BindingDB Entry DOI: 10.7270/Q2J102CP
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50076084
PNG
((3S,3aR,4R,4aS,8aR,9aS)-4-[3-(3,3-Dimethyl-piperid...)
Show SMILES C[C@@H]1OC(=O)[C@H]2C[C@H]3CCCC[C@@H]3[C@@H](CCCN3CCCC(C)(C)C3)[C@@H]12
Show InChI InChI=1S/C23H39NO2/c1-16-21-19(10-6-12-24-13-7-11-23(2,3)15-24)18-9-5-4-8-17(18)14-20(21)22(25)26-16/h16-21H,4-15H2,1-3H3/t16-,17+,18-,19+,20-,21+/m0/s1
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224n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards human muscarinic M2 receptor in CHO-KI cells using [3H]- QNB as radioligand


Bioorg Med Chem Lett 9: 901-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00101-8
BindingDB Entry DOI: 10.7270/Q2J102CP
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50076094
PNG
((3S,3aR,4R,4aS,8aR,9aS)-3-Methyl-4-[3-(4-methyl-pi...)
Show SMILES C[C@@H]1OC(=O)[C@H]2C[C@H]3CCCC[C@@H]3[C@@H](CCCN3CCC(C)CC3)[C@@H]12
Show InChI InChI=1S/C22H37NO2/c1-15-9-12-23(13-10-15)11-5-8-19-18-7-4-3-6-17(18)14-20-21(19)16(2)25-22(20)24/h15-21H,3-14H2,1-2H3/t16-,17+,18-,19+,20-,21+/m0/s1
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283n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards human muscarinic M2 receptor in CHO-KI cells using [3H]- QNB as radioligand


Bioorg Med Chem Lett 9: 901-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00101-8
BindingDB Entry DOI: 10.7270/Q2J102CP
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50076082
PNG
((3S,3aR,4R,4aS,8aR,9aS)-3-Methyl-4-[3-(3-methyl-pi...)
Show SMILES C[C@@H]1OC(=O)[C@H]2C[C@H]3CCCC[C@@H]3[C@@H](CCCN3CCCC(C)C3)[C@@H]12
Show InChI InChI=1S/C22H37NO2/c1-15-7-5-11-23(14-15)12-6-10-19-18-9-4-3-8-17(18)13-20-21(19)16(2)25-22(20)24/h15-21H,3-14H2,1-2H3/t15?,16-,17+,18-,19+,20-,21+/m0/s1
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312n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards human muscarinic M2 receptor in CHO-KI cells using [3H]- QNB as radioligand


Bioorg Med Chem Lett 9: 901-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00101-8
BindingDB Entry DOI: 10.7270/Q2J102CP
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50076096
PNG
((3S,3aR,4R,4aS,8aR,9aS)-3-Methyl-4-(3-piperidin-1-...)
Show SMILES C[C@@H]1OC(=O)[C@H]2C[C@H]3CCCC[C@@H]3[C@@H](CCCN3CCCCC3)[C@@H]12
Show InChI InChI=1S/C21H35NO2/c1-15-20-18(10-7-13-22-11-5-2-6-12-22)17-9-4-3-8-16(17)14-19(20)21(23)24-15/h15-20H,2-14H2,1H3/t15-,16+,17-,18+,19-,20+/m0/s1
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352n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards human muscarinic M2 receptor in CHO-KI cells using [3H]- QNB as radioligand


Bioorg Med Chem Lett 9: 901-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00101-8
BindingDB Entry DOI: 10.7270/Q2J102CP
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50076079
PNG
((3S,3aR,4R,4aS,8aR,9aS)-4-[3-(2,5-Dimethyl-piperaz...)
Show SMILES C[C@@H]1OC(=O)[C@H]2C[C@H]3CCCC[C@@H]3[C@@H](CCCN3CC(C)NCC3C)[C@@H]12
Show InChI InChI=1S/C22H38N2O2/c1-14-13-24(15(2)12-23-14)10-6-9-19-18-8-5-4-7-17(18)11-20-21(19)16(3)26-22(20)25/h14-21,23H,4-13H2,1-3H3/t14?,15?,16-,17+,18-,19+,20-,21+/m0/s1
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353n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards human muscarinic M1 receptor in CHO-KI cells using [3H]- QNB as radioligand


Bioorg Med Chem Lett 9: 901-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00101-8
BindingDB Entry DOI: 10.7270/Q2J102CP
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50076082
PNG
((3S,3aR,4R,4aS,8aR,9aS)-3-Methyl-4-[3-(3-methyl-pi...)
Show SMILES C[C@@H]1OC(=O)[C@H]2C[C@H]3CCCC[C@@H]3[C@@H](CCCN3CCCC(C)C3)[C@@H]12
Show InChI InChI=1S/C22H37NO2/c1-15-7-5-11-23(14-15)12-6-10-19-18-9-4-3-8-17(18)13-20-21(19)16(2)25-22(20)24/h15-21H,3-14H2,1-2H3/t15?,16-,17+,18-,19+,20-,21+/m0/s1
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376n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards human muscarinic M1 receptor in CHO-KI cells using [3H]- QNB as radioligand


Bioorg Med Chem Lett 9: 901-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00101-8
BindingDB Entry DOI: 10.7270/Q2J102CP
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50076084
PNG
((3S,3aR,4R,4aS,8aR,9aS)-4-[3-(3,3-Dimethyl-piperid...)
Show SMILES C[C@@H]1OC(=O)[C@H]2C[C@H]3CCCC[C@@H]3[C@@H](CCCN3CCCC(C)(C)C3)[C@@H]12
Show InChI InChI=1S/C23H39NO2/c1-16-21-19(10-6-12-24-13-7-11-23(2,3)15-24)18-9-5-4-8-17(18)14-20(21)22(25)26-16/h16-21H,4-15H2,1-3H3/t16-,17+,18-,19+,20-,21+/m0/s1
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416n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards human muscarinic M1 receptor in CHO-KI cells using [3H]- QNB as radioligand


Bioorg Med Chem Lett 9: 901-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00101-8
BindingDB Entry DOI: 10.7270/Q2J102CP
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50076092
PNG
((3S,3aR,4R,4aS,8aR,9aS)-3-Methyl-4-(3-piperazin-1-...)
Show SMILES C[C@@H]1OC(=O)[C@H]2C[C@H]3CCCC[C@@H]3[C@@H](CCCN3CCNCC3)[C@@H]12
Show InChI InChI=1S/C20H34N2O2/c1-14-19-17(7-4-10-22-11-8-21-9-12-22)16-6-3-2-5-15(16)13-18(19)20(23)24-14/h14-19,21H,2-13H2,1H3/t14-,15+,16-,17+,18-,19+/m0/s1
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>420n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards human muscarinic M1 receptor in CHO-KI cells using [3H]- QNB as radioligand


Bioorg Med Chem Lett 9: 901-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00101-8
BindingDB Entry DOI: 10.7270/Q2J102CP
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50076096
PNG
((3S,3aR,4R,4aS,8aR,9aS)-3-Methyl-4-(3-piperidin-1-...)
Show SMILES C[C@@H]1OC(=O)[C@H]2C[C@H]3CCCC[C@@H]3[C@@H](CCCN3CCCCC3)[C@@H]12
Show InChI InChI=1S/C21H35NO2/c1-15-20-18(10-7-13-22-11-5-2-6-12-22)17-9-4-3-8-16(17)14-19(20)21(23)24-15/h15-20H,2-14H2,1H3/t15-,16+,17-,18+,19-,20+/m0/s1
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427n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards human muscarinic M1 receptor in CHO-KI cells using [3H]- QNB as radioligand


Bioorg Med Chem Lett 9: 901-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00101-8
BindingDB Entry DOI: 10.7270/Q2J102CP
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50076098
PNG
((3S,3aR,4R,4aS,8aR,9aS)-4-[3-(4-Cyclohexyl-piperaz...)
Show SMILES C[C@@H]1OC(=O)[C@H]2C[C@H]3CCCC[C@@H]3[C@@H](CCCN3CCN(CC3)C3CCCCC3)[C@@H]12
Show InChI InChI=1S/C26H44N2O2/c1-19-25-23(22-11-6-5-8-20(22)18-24(25)26(29)30-19)12-7-13-27-14-16-28(17-15-27)21-9-3-2-4-10-21/h19-25H,2-18H2,1H3/t19-,20+,22-,23+,24-,25+/m0/s1
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464n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards human muscarinic M1 receptor in CHO-KI cells using [3H]- QNB as radioligand


Bioorg Med Chem Lett 9: 901-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00101-8
BindingDB Entry DOI: 10.7270/Q2J102CP
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50076078
PNG
((3S,3aR,4R,4aS,8aR,9aS)-4-[3-(3,5-Dimethyl-piperaz...)
Show SMILES C[C@@H]1OC(=O)[C@H]2C[C@H]3CCCC[C@@H]3[C@@H](CCCN3CC(C)NC(C)C3)[C@@H]12
Show InChI InChI=1S/C22H38N2O2/c1-14-12-24(13-15(2)23-14)10-6-9-19-18-8-5-4-7-17(18)11-20-21(19)16(3)26-22(20)25/h14-21,23H,4-13H2,1-3H3/t14?,15?,16-,17+,18-,19+,20-,21+/m0/s1
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>500n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards human muscarinic M2 receptor in CHO-KI cells using [3H]- QNB as radioligand


Bioorg Med Chem Lett 9: 901-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00101-8
BindingDB Entry DOI: 10.7270/Q2J102CP
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50076081
PNG
((3S,3aR,4R,4aS,8aR,9aS)-3-Methyl-4-[3-((S)-3-methy...)
Show SMILES C[C@@H]1OC(=O)[C@H]2C[C@H]3CCCC[C@@H]3[C@@H](CCCN3CCN[C@@H](C)C3)[C@@H]12
Show InChI InChI=1S/C21H36N2O2/c1-14-13-23(11-9-22-14)10-5-8-18-17-7-4-3-6-16(17)12-19-20(18)15(2)25-21(19)24/h14-20,22H,3-13H2,1-2H3/t14-,15-,16+,17-,18+,19-,20+/m0/s1
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>500n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards human muscarinic M2 receptor in CHO-KI cells using [3H]- QNB as radioligand


Bioorg Med Chem Lett 9: 901-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00101-8
BindingDB Entry DOI: 10.7270/Q2J102CP
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50076099
PNG
((3S,3aR,4R,4aS,8aR,9aS)-3-Methyl-4-[3-((R)-3-methy...)
Show SMILES C[C@@H]1OC(=O)[C@H]2C[C@H]3CCCC[C@@H]3[C@@H](CCCN3CCN[C@H](C)C3)[C@@H]12
Show InChI InChI=1S/C21H36N2O2/c1-14-13-23(11-9-22-14)10-5-8-18-17-7-4-3-6-16(17)12-19-20(18)15(2)25-21(19)24/h14-20,22H,3-13H2,1-2H3/t14-,15+,16-,17+,18-,19+,20-/m1/s1
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>500n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards human muscarinic M2 receptor in CHO-KI cells using [3H]- QNB as radioligand


Bioorg Med Chem Lett 9: 901-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00101-8
BindingDB Entry DOI: 10.7270/Q2J102CP
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50076098
PNG
((3S,3aR,4R,4aS,8aR,9aS)-4-[3-(4-Cyclohexyl-piperaz...)
Show SMILES C[C@@H]1OC(=O)[C@H]2C[C@H]3CCCC[C@@H]3[C@@H](CCCN3CCN(CC3)C3CCCCC3)[C@@H]12
Show InChI InChI=1S/C26H44N2O2/c1-19-25-23(22-11-6-5-8-20(22)18-24(25)26(29)30-19)12-7-13-27-14-16-28(17-15-27)21-9-3-2-4-10-21/h19-25H,2-18H2,1H3/t19-,20+,22-,23+,24-,25+/m0/s1
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520n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards human muscarinic M2 receptor in CHO-KI cells using [3H]- QNB as radioligand


Bioorg Med Chem Lett 9: 901-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00101-8
BindingDB Entry DOI: 10.7270/Q2J102CP
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50076094
PNG
((3S,3aR,4R,4aS,8aR,9aS)-3-Methyl-4-[3-(4-methyl-pi...)
Show SMILES C[C@@H]1OC(=O)[C@H]2C[C@H]3CCCC[C@@H]3[C@@H](CCCN3CCC(C)CC3)[C@@H]12
Show InChI InChI=1S/C22H37NO2/c1-15-9-12-23(13-10-15)11-5-8-19-18-7-4-3-6-17(18)14-20-21(19)16(2)25-22(20)24/h15-21H,3-14H2,1-2H3/t16-,17+,18-,19+,20-,21+/m0/s1
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554n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards human muscarinic M1 receptor in CHO-KI cells using [3H]- QNB as radioligand


Bioorg Med Chem Lett 9: 901-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00101-8
BindingDB Entry DOI: 10.7270/Q2J102CP
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50076079
PNG
((3S,3aR,4R,4aS,8aR,9aS)-4-[3-(2,5-Dimethyl-piperaz...)
Show SMILES C[C@@H]1OC(=O)[C@H]2C[C@H]3CCCC[C@@H]3[C@@H](CCCN3CC(C)NCC3C)[C@@H]12
Show InChI InChI=1S/C22H38N2O2/c1-14-13-24(15(2)12-23-14)10-6-9-19-18-8-5-4-7-17(18)11-20-21(19)16(3)26-22(20)25/h14-21,23H,4-13H2,1-3H3/t14?,15?,16-,17+,18-,19+,20-,21+/m0/s1
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570n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards human muscarinic M2 receptor in CHO-KI cells using [3H]- QNB as radioligand


Bioorg Med Chem Lett 9: 901-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00101-8
BindingDB Entry DOI: 10.7270/Q2J102CP
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50076081
PNG
((3S,3aR,4R,4aS,8aR,9aS)-3-Methyl-4-[3-((S)-3-methy...)
Show SMILES C[C@@H]1OC(=O)[C@H]2C[C@H]3CCCC[C@@H]3[C@@H](CCCN3CCN[C@@H](C)C3)[C@@H]12
Show InChI InChI=1S/C21H36N2O2/c1-14-13-23(11-9-22-14)10-5-8-18-17-7-4-3-6-16(17)12-19-20(18)15(2)25-21(19)24/h14-20,22H,3-13H2,1-2H3/t14-,15-,16+,17-,18+,19-,20+/m0/s1
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581n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards human muscarinic M1 receptor in CHO-KI cells using [3H]- QNB as radioligand


Bioorg Med Chem Lett 9: 901-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00101-8
BindingDB Entry DOI: 10.7270/Q2J102CP
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50076099
PNG
((3S,3aR,4R,4aS,8aR,9aS)-3-Methyl-4-[3-((R)-3-methy...)
Show SMILES C[C@@H]1OC(=O)[C@H]2C[C@H]3CCCC[C@@H]3[C@@H](CCCN3CCN[C@H](C)C3)[C@@H]12
Show InChI InChI=1S/C21H36N2O2/c1-14-13-23(11-9-22-14)10-5-8-18-17-7-4-3-6-16(17)12-19-20(18)15(2)25-21(19)24/h14-20,22H,3-13H2,1-2H3/t14-,15+,16-,17+,18-,19+,20-/m1/s1
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
857n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards human muscarinic M1 receptor in CHO-KI cells using [3H]- QNB as radioligand


Bioorg Med Chem Lett 9: 901-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00101-8
BindingDB Entry DOI: 10.7270/Q2J102CP
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50076078
PNG
((3S,3aR,4R,4aS,8aR,9aS)-4-[3-(3,5-Dimethyl-piperaz...)
Show SMILES C[C@@H]1OC(=O)[C@H]2C[C@H]3CCCC[C@@H]3[C@@H](CCCN3CC(C)NC(C)C3)[C@@H]12
Show InChI InChI=1S/C22H38N2O2/c1-14-12-24(13-15(2)23-14)10-6-9-19-18-8-5-4-7-17(18)11-20-21(19)16(3)26-22(20)25/h14-21,23H,4-13H2,1-3H3/t14?,15?,16-,17+,18-,19+,20-,21+/m0/s1
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.36E+3n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity towards human muscarinic M1 receptor in CHO-KI cells using [3H]- QNB as radioligand


Bioorg Med Chem Lett 9: 901-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00101-8
BindingDB Entry DOI: 10.7270/Q2J102CP
More data for this
Ligand-Target Pair