Found 107 hits with Last Name = 'atzler' and Initial = 'k' Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Muscarinic acetylcholine receptor M2
(Homo sapiens (Human)) | BDBM50451113
(CHEMBL2114068)Show SMILES COc1ccc(cc1)[S@+]([O-])c1ccc(cc1)C(=C)C1CCN(CC1)C1CCCCC1 |r| Show InChI InChI=1S/C26H33NO2S/c1-20(22-16-18-27(19-17-22)23-6-4-3-5-7-23)21-8-12-25(13-9-21)30(28)26-14-10-24(29-2)11-15-26/h8-15,22-23H,1,3-7,16-19H2,2H3/t30-/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.0300 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M2 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M2
(Homo sapiens (Human)) | BDBM50451114
(CHEMBL2115128)Show SMILES COc1ccc(cc1)[S@@+]([O-])c1ccc(cc1)C(=C)C1CCN(CC1)C1CCCCC1 |r| Show InChI InChI=1S/C26H33NO2S/c1-20(22-16-18-27(19-17-22)23-6-4-3-5-7-23)21-8-12-25(13-9-21)30(28)26-14-10-24(29-2)11-15-26/h8-15,22-23H,1,3-7,16-19H2,2H3/t30-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.0570 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M2 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M4
(Homo sapiens (Human)) | BDBM50092313
(1-Cyclohexyl-4-{1-[4-(4-methoxy-benzenesulfinyl)-p...)Show SMILES COc1ccc(cc1)S(=O)c1ccc(cc1)C(C)C1CCN(CC1)C1CCCCC1 Show InChI InChI=1S/C26H35NO2S/c1-20(22-16-18-27(19-17-22)23-6-4-3-5-7-23)21-8-12-25(13-9-21)30(28)26-14-10-24(29-2)11-15-26/h8-15,20,22-23H,3-7,16-19H2,1-2H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.0700 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M4 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M4
(Homo sapiens (Human)) | BDBM50451113
(CHEMBL2114068)Show SMILES COc1ccc(cc1)[S@+]([O-])c1ccc(cc1)C(=C)C1CCN(CC1)C1CCCCC1 |r| Show InChI InChI=1S/C26H33NO2S/c1-20(22-16-18-27(19-17-22)23-6-4-3-5-7-23)21-8-12-25(13-9-21)30(28)26-14-10-24(29-2)11-15-26/h8-15,22-23H,1,3-7,16-19H2,2H3/t30-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.0900 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M4 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M3
(Homo sapiens (Human)) | BDBM50451113
(CHEMBL2114068)Show SMILES COc1ccc(cc1)[S@+]([O-])c1ccc(cc1)C(=C)C1CCN(CC1)C1CCCCC1 |r| Show InChI InChI=1S/C26H33NO2S/c1-20(22-16-18-27(19-17-22)23-6-4-3-5-7-23)21-8-12-25(13-9-21)30(28)26-14-10-24(29-2)11-15-26/h8-15,22-23H,1,3-7,16-19H2,2H3/t30-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M3 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M2
(Homo sapiens (Human)) | BDBM50092313
(1-Cyclohexyl-4-{1-[4-(4-methoxy-benzenesulfinyl)-p...)Show SMILES COc1ccc(cc1)S(=O)c1ccc(cc1)C(C)C1CCN(CC1)C1CCCCC1 Show InChI InChI=1S/C26H35NO2S/c1-20(22-16-18-27(19-17-22)23-6-4-3-5-7-23)21-8-12-25(13-9-21)30(28)26-14-10-24(29-2)11-15-26/h8-15,20,22-23H,3-7,16-19H2,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.140 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M2 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M3
(Homo sapiens (Human)) | BDBM50092313
(1-Cyclohexyl-4-{1-[4-(4-methoxy-benzenesulfinyl)-p...)Show SMILES COc1ccc(cc1)S(=O)c1ccc(cc1)C(C)C1CCN(CC1)C1CCCCC1 Show InChI InChI=1S/C26H35NO2S/c1-20(22-16-18-27(19-17-22)23-6-4-3-5-7-23)21-8-12-25(13-9-21)30(28)26-14-10-24(29-2)11-15-26/h8-15,20,22-23H,3-7,16-19H2,1-2H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.160 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M3 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M2
(Homo sapiens (Human)) | BDBM50092321
(1-Cyclohexyl-4-{1-[4-(4-methoxy-benzenesulfonyl)-p...)Show SMILES COc1ccc(cc1)S(=O)(=O)c1ccc(cc1)C(=C)C1CCN(CC1)C1CCCCC1 Show InChI InChI=1S/C26H33NO3S/c1-20(22-16-18-27(19-17-22)23-6-4-3-5-7-23)21-8-12-25(13-9-21)31(28,29)26-14-10-24(30-2)11-15-26/h8-15,22-23H,1,3-7,16-19H2,2H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 0.170 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M2 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M4
(Homo sapiens (Human)) | BDBM50451114
(CHEMBL2115128)Show SMILES COc1ccc(cc1)[S@@+]([O-])c1ccc(cc1)C(=C)C1CCN(CC1)C1CCCCC1 |r| Show InChI InChI=1S/C26H33NO2S/c1-20(22-16-18-27(19-17-22)23-6-4-3-5-7-23)21-8-12-25(13-9-21)30(28)26-14-10-24(29-2)11-15-26/h8-15,22-23H,1,3-7,16-19H2,2H3/t30-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.320 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M4 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M4
(Homo sapiens (Human)) | BDBM50092321
(1-Cyclohexyl-4-{1-[4-(4-methoxy-benzenesulfonyl)-p...)Show SMILES COc1ccc(cc1)S(=O)(=O)c1ccc(cc1)C(=C)C1CCN(CC1)C1CCCCC1 Show InChI InChI=1S/C26H33NO3S/c1-20(22-16-18-27(19-17-22)23-6-4-3-5-7-23)21-8-12-25(13-9-21)31(28,29)26-14-10-24(30-2)11-15-26/h8-15,22-23H,1,3-7,16-19H2,2H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 0.330 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M4 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M2
(Homo sapiens (Human)) | BDBM50092322
(1-Cyclohexyl-4-{1-[4-(4-methoxy-phenylsulfanyl)-ph...)Show SMILES COc1ccc(Sc2ccc(cc2)C(=C)C2CCN(CC2)C2CCCCC2)cc1 Show InChI InChI=1S/C26H33NOS/c1-20(22-16-18-27(19-17-22)23-6-4-3-5-7-23)21-8-12-25(13-9-21)29-26-14-10-24(28-2)11-15-26/h8-15,22-23H,1,3-7,16-19H2,2H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 0.370 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M2 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M3
(Homo sapiens (Human)) | BDBM50451114
(CHEMBL2115128)Show SMILES COc1ccc(cc1)[S@@+]([O-])c1ccc(cc1)C(=C)C1CCN(CC1)C1CCCCC1 |r| Show InChI InChI=1S/C26H33NO2S/c1-20(22-16-18-27(19-17-22)23-6-4-3-5-7-23)21-8-12-25(13-9-21)30(28)26-14-10-24(29-2)11-15-26/h8-15,22-23H,1,3-7,16-19H2,2H3/t30-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.380 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M3 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M3
(Homo sapiens (Human)) | BDBM50092321
(1-Cyclohexyl-4-{1-[4-(4-methoxy-benzenesulfonyl)-p...)Show SMILES COc1ccc(cc1)S(=O)(=O)c1ccc(cc1)C(=C)C1CCN(CC1)C1CCCCC1 Show InChI InChI=1S/C26H33NO3S/c1-20(22-16-18-27(19-17-22)23-6-4-3-5-7-23)21-8-12-25(13-9-21)31(28,29)26-14-10-24(30-2)11-15-26/h8-15,22-23H,1,3-7,16-19H2,2H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 0.480 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M3 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human)) | BDBM50092313
(1-Cyclohexyl-4-{1-[4-(4-methoxy-benzenesulfinyl)-p...)Show SMILES COc1ccc(cc1)S(=O)c1ccc(cc1)C(C)C1CCN(CC1)C1CCCCC1 Show InChI InChI=1S/C26H35NO2S/c1-20(22-16-18-27(19-17-22)23-6-4-3-5-7-23)21-8-12-25(13-9-21)30(28)26-14-10-24(29-2)11-15-26/h8-15,20,22-23H,3-7,16-19H2,1-2H3 | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.530 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M1 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human)) | BDBM50451113
(CHEMBL2114068)Show SMILES COc1ccc(cc1)[S@+]([O-])c1ccc(cc1)C(=C)C1CCN(CC1)C1CCCCC1 |r| Show InChI InChI=1S/C26H33NO2S/c1-20(22-16-18-27(19-17-22)23-6-4-3-5-7-23)21-8-12-25(13-9-21)30(28)26-14-10-24(29-2)11-15-26/h8-15,22-23H,1,3-7,16-19H2,2H3/t30-/m1/s1 | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.680 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M1 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M3
(Homo sapiens (Human)) | BDBM50092319
(1-Cyclohexyl-4-{1-[4-(4-methoxy-benzenesulfinyl)-p...)Show SMILES COc1ccc(cc1)S(=O)c1ccc(cc1)C(C)N1CCN(CC1)C1CCCCC1 Show InChI InChI=1S/C25H34N2O2S/c1-20(26-16-18-27(19-17-26)22-6-4-3-5-7-22)21-8-12-24(13-9-21)30(28)25-14-10-23(29-2)11-15-25/h8-15,20,22H,3-7,16-19H2,1-2H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 0.970 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M3 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M2
(Homo sapiens (Human)) | BDBM50092319
(1-Cyclohexyl-4-{1-[4-(4-methoxy-benzenesulfinyl)-p...)Show SMILES COc1ccc(cc1)S(=O)c1ccc(cc1)C(C)N1CCN(CC1)C1CCCCC1 Show InChI InChI=1S/C25H34N2O2S/c1-20(26-16-18-27(19-17-26)22-6-4-3-5-7-22)21-8-12-24(13-9-21)30(28)25-14-10-23(29-2)11-15-25/h8-15,20,22H,3-7,16-19H2,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M2 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M2
(Homo sapiens (Human)) | BDBM50092315
((1-Cyclohexyl-piperidin-4-yl)-[4-(4-methoxy-benzen...)Show SMILES COc1ccc(cc1)S(=O)(=O)c1ccc(cc1)C(C#N)C1CCN(CC1)C1CCCCC1 Show InChI InChI=1S/C26H32N2O3S/c1-31-23-9-13-25(14-10-23)32(29,30)24-11-7-20(8-12-24)26(19-27)21-15-17-28(18-16-21)22-5-3-2-4-6-22/h7-14,21-22,26H,2-6,15-18H2,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M2 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M5
(Homo sapiens (Human)) | BDBM50092313
(1-Cyclohexyl-4-{1-[4-(4-methoxy-benzenesulfinyl)-p...)Show SMILES COc1ccc(cc1)S(=O)c1ccc(cc1)C(C)C1CCN(CC1)C1CCCCC1 Show InChI InChI=1S/C26H35NO2S/c1-20(22-16-18-27(19-17-22)23-6-4-3-5-7-23)21-8-12-25(13-9-21)30(28)26-14-10-24(29-2)11-15-26/h8-15,20,22-23H,3-7,16-19H2,1-2H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
The compound was tested for the binding affinity against Muscarinic acetylcholine receptor M5 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human)) | BDBM50451114
(CHEMBL2115128)Show SMILES COc1ccc(cc1)[S@@+]([O-])c1ccc(cc1)C(=C)C1CCN(CC1)C1CCCCC1 |r| Show InChI InChI=1S/C26H33NO2S/c1-20(22-16-18-27(19-17-22)23-6-4-3-5-7-23)21-8-12-25(13-9-21)30(28)26-14-10-24(29-2)11-15-26/h8-15,22-23H,1,3-7,16-19H2,2H3/t30-/m0/s1 | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 2.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M1 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M4
(Homo sapiens (Human)) | BDBM50092319
(1-Cyclohexyl-4-{1-[4-(4-methoxy-benzenesulfinyl)-p...)Show SMILES COc1ccc(cc1)S(=O)c1ccc(cc1)C(C)N1CCN(CC1)C1CCCCC1 Show InChI InChI=1S/C25H34N2O2S/c1-20(26-16-18-27(19-17-26)22-6-4-3-5-7-22)21-8-12-24(13-9-21)30(28)25-14-10-23(29-2)11-15-25/h8-15,20,22H,3-7,16-19H2,1-2H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 2.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M4 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human)) | BDBM50092321
(1-Cyclohexyl-4-{1-[4-(4-methoxy-benzenesulfonyl)-p...)Show SMILES COc1ccc(cc1)S(=O)(=O)c1ccc(cc1)C(=C)C1CCN(CC1)C1CCCCC1 Show InChI InChI=1S/C26H33NO3S/c1-20(22-16-18-27(19-17-22)23-6-4-3-5-7-23)21-8-12-25(13-9-21)31(28,29)26-14-10-24(30-2)11-15-26/h8-15,22-23H,1,3-7,16-19H2,2H3 | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 2.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M1 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M2
(Homo sapiens (Human)) | BDBM50451110
(CHEMBL2111540)Show SMILES COc1ccc(cc1)[S@@+]([O-])c1ccc(cc1)C(C#N)N1CCN(CC1)C1CCCCC1 |r| Show InChI InChI=1S/C25H31N3O2S/c1-30-22-9-13-24(14-10-22)31(29)23-11-7-20(8-12-23)25(19-26)28-17-15-27(16-18-28)21-5-3-2-4-6-21/h7-14,21,25H,2-6,15-18H2,1H3/t25?,31-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 2.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M2 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M2
(Homo sapiens (Human)) | BDBM50092314
((1-Cyclohexyl-piperidin-4-yl)-[4-(4-methoxy-benzen...)Show SMILES COc1ccc(cc1)S(=O)(=O)c1ccc(cc1)C(=O)C1CCN(CC1)C1CCCCC1 Show InChI InChI=1S/C25H31NO4S/c1-30-22-9-13-24(14-10-22)31(28,29)23-11-7-19(8-12-23)25(27)20-15-17-26(18-16-20)21-5-3-2-4-6-21/h7-14,20-21H,2-6,15-18H2,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 3.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M2 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M2
(Homo sapiens (Human)) | BDBM50451111
(CHEMBL2114067)Show SMILES COc1ccc(cc1)[S@@+]([O-])c1ccc(cc1)C(=O)C1CCN(CC1)C1CCCCC1 |r| Show InChI InChI=1S/C25H31NO3S/c1-29-22-9-13-24(14-10-22)30(28)23-11-7-19(8-12-23)25(27)20-15-17-26(18-16-20)21-5-3-2-4-6-21/h7-14,20-21H,2-6,15-18H2,1H3/t30-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 3.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M2 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human)) | BDBM50092322
(1-Cyclohexyl-4-{1-[4-(4-methoxy-phenylsulfanyl)-ph...)Show SMILES COc1ccc(Sc2ccc(cc2)C(=C)C2CCN(CC2)C2CCCCC2)cc1 Show InChI InChI=1S/C26H33NOS/c1-20(22-16-18-27(19-17-22)23-6-4-3-5-7-23)21-8-12-25(13-9-21)29-26-14-10-24(28-2)11-15-26/h8-15,22-23H,1,3-7,16-19H2,2H3 | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 4.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M1 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human)) | BDBM50092319
(1-Cyclohexyl-4-{1-[4-(4-methoxy-benzenesulfinyl)-p...)Show SMILES COc1ccc(cc1)S(=O)c1ccc(cc1)C(C)N1CCN(CC1)C1CCCCC1 Show InChI InChI=1S/C25H34N2O2S/c1-20(26-16-18-27(19-17-26)22-6-4-3-5-7-22)21-8-12-24(13-9-21)30(28)25-14-10-23(29-2)11-15-25/h8-15,20,22H,3-7,16-19H2,1-2H3 | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M1 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M3
(Homo sapiens (Human)) | BDBM50092320
((4-Cyclohexyl-piperazin-1-yl)-[4-(4-methoxy-benzen...)Show SMILES COc1ccc(cc1)S(=O)(=O)c1ccc(cc1)C(C#N)N1CCN(CC1)C1CCCCC1 Show InChI InChI=1S/C25H31N3O3S/c1-31-22-9-13-24(14-10-22)32(29,30)23-11-7-20(8-12-23)25(19-26)28-17-15-27(16-18-28)21-5-3-2-4-6-21/h7-14,21,25H,2-6,15-18H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 6.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M3 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M2
(Homo sapiens (Human)) | BDBM50451116
(CHEMBL2115126)Show SMILES COc1ccc(cc1)[S@+]([O-])c1ccc(cc1)C(C#N)C1CCN(CC1)C1CCCCC1 |r| Show InChI InChI=1S/C26H32N2O2S/c1-30-23-9-13-25(14-10-23)31(29)24-11-7-20(8-12-24)26(19-27)21-15-17-28(18-16-21)22-5-3-2-4-6-22/h7-14,21-22,26H,2-6,15-18H2,1H3/t26?,31-/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 7.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M2 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M2
(Homo sapiens (Human)) | BDBM50092320
((4-Cyclohexyl-piperazin-1-yl)-[4-(4-methoxy-benzen...)Show SMILES COc1ccc(cc1)S(=O)(=O)c1ccc(cc1)C(C#N)N1CCN(CC1)C1CCCCC1 Show InChI InChI=1S/C25H31N3O3S/c1-31-22-9-13-24(14-10-22)32(29,30)23-11-7-20(8-12-23)25(19-26)28-17-15-27(16-18-28)21-5-3-2-4-6-21/h7-14,21,25H,2-6,15-18H2,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 7.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M2 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M2
(Homo sapiens (Human)) | BDBM50451109
(CHEMBL2114064)Show SMILES COc1ccc(cc1)[S@@+]([O-])c1ccc(cc1)C(C#N)C1CCN(CC1)C1CCCCC1 |r| Show InChI InChI=1S/C26H32N2O2S/c1-30-23-9-13-25(14-10-23)31(29)24-11-7-20(8-12-24)26(19-27)21-15-17-28(18-16-21)22-5-3-2-4-6-22/h7-14,21-22,26H,2-6,15-18H2,1H3/t26?,31-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 7.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M2 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M4
(Homo sapiens (Human)) | BDBM50092314
((1-Cyclohexyl-piperidin-4-yl)-[4-(4-methoxy-benzen...)Show SMILES COc1ccc(cc1)S(=O)(=O)c1ccc(cc1)C(=O)C1CCN(CC1)C1CCCCC1 Show InChI InChI=1S/C25H31NO4S/c1-30-22-9-13-24(14-10-22)31(28,29)23-11-7-19(8-12-23)25(27)20-15-17-26(18-16-20)21-5-3-2-4-6-21/h7-14,20-21H,2-6,15-18H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 9.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M4 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M2
(Homo sapiens (Human)) | BDBM50451115
(CHEMBL2115127)Show SMILES COc1ccc(cc1)[S@+]([O-])c1ccc(cc1)C(=O)C1CCN(CC1)C1CCCCC1 |r| Show InChI InChI=1S/C25H31NO3S/c1-29-22-9-13-24(14-10-22)30(28)23-11-7-19(8-12-23)25(27)20-15-17-26(18-16-20)21-5-3-2-4-6-21/h7-14,20-21H,2-6,15-18H2,1H3/t30-/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 11 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M2 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M4
(Homo sapiens (Human)) | BDBM50451109
(CHEMBL2114064)Show SMILES COc1ccc(cc1)[S@@+]([O-])c1ccc(cc1)C(C#N)C1CCN(CC1)C1CCCCC1 |r| Show InChI InChI=1S/C26H32N2O2S/c1-30-23-9-13-25(14-10-23)31(29)24-11-7-20(8-12-24)26(19-27)21-15-17-28(18-16-21)22-5-3-2-4-6-22/h7-14,21-22,26H,2-6,15-18H2,1H3/t26?,31-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 13 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M4 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M3
(Homo sapiens (Human)) | BDBM50092314
((1-Cyclohexyl-piperidin-4-yl)-[4-(4-methoxy-benzen...)Show SMILES COc1ccc(cc1)S(=O)(=O)c1ccc(cc1)C(=O)C1CCN(CC1)C1CCCCC1 Show InChI InChI=1S/C25H31NO4S/c1-30-22-9-13-24(14-10-22)31(28,29)23-11-7-19(8-12-23)25(27)20-15-17-26(18-16-20)21-5-3-2-4-6-21/h7-14,20-21H,2-6,15-18H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 14 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M3 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M4
(Homo sapiens (Human)) | BDBM50451115
(CHEMBL2115127)Show SMILES COc1ccc(cc1)[S@+]([O-])c1ccc(cc1)C(=O)C1CCN(CC1)C1CCCCC1 |r| Show InChI InChI=1S/C25H31NO3S/c1-29-22-9-13-24(14-10-22)30(28)23-11-7-19(8-12-23)25(27)20-15-17-26(18-16-20)21-5-3-2-4-6-21/h7-14,20-21H,2-6,15-18H2,1H3/t30-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 15 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M4 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M4
(Homo sapiens (Human)) | BDBM50451110
(CHEMBL2111540)Show SMILES COc1ccc(cc1)[S@@+]([O-])c1ccc(cc1)C(C#N)N1CCN(CC1)C1CCCCC1 |r| Show InChI InChI=1S/C25H31N3O2S/c1-30-22-9-13-24(14-10-22)31(29)23-11-7-20(8-12-23)25(19-26)28-17-15-27(16-18-28)21-5-3-2-4-6-21/h7-14,21,25H,2-6,15-18H2,1H3/t25?,31-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 15 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M4 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human)) | BDBM50092315
((1-Cyclohexyl-piperidin-4-yl)-[4-(4-methoxy-benzen...)Show SMILES COc1ccc(cc1)S(=O)(=O)c1ccc(cc1)C(C#N)C1CCN(CC1)C1CCCCC1 Show InChI InChI=1S/C26H32N2O3S/c1-31-23-9-13-25(14-10-23)32(29,30)24-11-7-20(8-12-24)26(19-27)21-15-17-28(18-16-21)22-5-3-2-4-6-22/h7-14,21-22,26H,2-6,15-18H2,1H3 | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 16 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M1 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M2
(Homo sapiens (Human)) | BDBM50451112
(CHEMBL2114066)Show SMILES COc1ccc(cc1)[S@+]([O-])c1ccc(cc1)C(C#N)N1CCN(CC1)C1CCCCC1 |r| Show InChI InChI=1S/C25H31N3O2S/c1-30-22-9-13-24(14-10-22)31(29)23-11-7-20(8-12-23)25(19-26)28-17-15-27(16-18-28)21-5-3-2-4-6-21/h7-14,21,25H,2-6,15-18H2,1H3/t25?,31-/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 17 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M2 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M4
(Homo sapiens (Human)) | BDBM50451111
(CHEMBL2114067)Show SMILES COc1ccc(cc1)[S@@+]([O-])c1ccc(cc1)C(=O)C1CCN(CC1)C1CCCCC1 |r| Show InChI InChI=1S/C25H31NO3S/c1-29-22-9-13-24(14-10-22)30(28)23-11-7-19(8-12-23)25(27)20-15-17-26(18-16-20)21-5-3-2-4-6-21/h7-14,20-21H,2-6,15-18H2,1H3/t30-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 18 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M4 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M4
(Homo sapiens (Human)) | BDBM50451112
(CHEMBL2114066)Show SMILES COc1ccc(cc1)[S@+]([O-])c1ccc(cc1)C(C#N)N1CCN(CC1)C1CCCCC1 |r| Show InChI InChI=1S/C25H31N3O2S/c1-30-22-9-13-24(14-10-22)31(29)23-11-7-20(8-12-23)25(19-26)28-17-15-27(16-18-28)21-5-3-2-4-6-21/h7-14,21,25H,2-6,15-18H2,1H3/t25?,31-/m1/s1 | PDB
Reactome pathway
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| 18 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M4 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M4
(Homo sapiens (Human)) | BDBM50092320
((4-Cyclohexyl-piperazin-1-yl)-[4-(4-methoxy-benzen...)Show SMILES COc1ccc(cc1)S(=O)(=O)c1ccc(cc1)C(C#N)N1CCN(CC1)C1CCCCC1 Show InChI InChI=1S/C25H31N3O3S/c1-31-22-9-13-24(14-10-22)32(29,30)23-11-7-20(8-12-23)25(19-26)28-17-15-27(16-18-28)21-5-3-2-4-6-21/h7-14,21,25H,2-6,15-18H2,1H3 | PDB
Reactome pathway
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| 19 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M4 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M3
(Homo sapiens (Human)) | BDBM50451115
(CHEMBL2115127)Show SMILES COc1ccc(cc1)[S@+]([O-])c1ccc(cc1)C(=O)C1CCN(CC1)C1CCCCC1 |r| Show InChI InChI=1S/C25H31NO3S/c1-29-22-9-13-24(14-10-22)30(28)23-11-7-19(8-12-23)25(27)20-15-17-26(18-16-20)21-5-3-2-4-6-21/h7-14,20-21H,2-6,15-18H2,1H3/t30-/m1/s1 | PDB
Reactome pathway
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| 20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M3 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
P2Y purinoceptor 12
(Homo sapiens (Human)) | BDBM50268964
(CHEMBL502519 | Sodium 1-Amino-4-[4-phenylamino-3-c...)Show SMILES Nc1c(cc(Nc2ccc(Nc3ccccc3)c(c2)S([O-])(=O)=O)c2C(=O)c3ccccc3C(=O)c12)C(O)=O Show InChI InChI=1S/C27H19N3O7S/c28-24-18(27(33)34)13-20(22-23(24)26(32)17-9-5-4-8-16(17)25(22)31)30-15-10-11-19(21(12-15)38(35,36)37)29-14-6-2-1-3-7-14/h1-13,29-30H,28H2,(H,33,34)(H,35,36,37)/p-1 | PDB
Reactome pathway
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PubMed
| 21 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description
Displacement of [3H]PSB0413 from human platelet P2Y12 receptor |
J Med Chem 52: 3784-93 (2009)
Article DOI: 10.1021/jm9003297
BindingDB Entry DOI: 10.7270/Q2NK3FZF |
More data for this
Ligand-Target Pair | |
P2Y purinoceptor 12
(Homo sapiens (Human)) | BDBM50268877
(CHEMBL455536 | Disodium 1-Amino-4-[4-phenylamino-3...)Show SMILES Nc1c2C(=O)c3ccccc3C(=O)c2c(Nc2ccc(Nc3ccccc3)c(c2)S([O-])(=O)=O)cc1S([O-])(=O)=O Show InChI InChI=1S/C26H19N3O8S2/c27-24-21(39(35,36)37)13-19(22-23(24)26(31)17-9-5-4-8-16(17)25(22)30)29-15-10-11-18(20(12-15)38(32,33)34)28-14-6-2-1-3-7-14/h1-13,28-29H,27H2,(H,32,33,34)(H,35,36,37)/p-2 | PDB
Reactome pathway
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PubMed
| 24.9 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description
Displacement of [3H]PSB0413 from human platelet P2Y12 receptor |
J Med Chem 52: 3784-93 (2009)
Article DOI: 10.1021/jm9003297
BindingDB Entry DOI: 10.7270/Q2NK3FZF |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M3
(Homo sapiens (Human)) | BDBM50451111
(CHEMBL2114067)Show SMILES COc1ccc(cc1)[S@@+]([O-])c1ccc(cc1)C(=O)C1CCN(CC1)C1CCCCC1 |r| Show InChI InChI=1S/C25H31NO3S/c1-29-22-9-13-24(14-10-22)30(28)23-11-7-19(8-12-23)25(27)20-15-17-26(18-16-20)21-5-3-2-4-6-21/h7-14,20-21H,2-6,15-18H2,1H3/t30-/m0/s1 | PDB
Reactome pathway
KEGG
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Similars
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| 28 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M3 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M3
(Homo sapiens (Human)) | BDBM50451110
(CHEMBL2111540)Show SMILES COc1ccc(cc1)[S@@+]([O-])c1ccc(cc1)C(C#N)N1CCN(CC1)C1CCCCC1 |r| Show InChI InChI=1S/C25H31N3O2S/c1-30-22-9-13-24(14-10-22)31(29)23-11-7-20(8-12-23)25(19-26)28-17-15-27(16-18-28)21-5-3-2-4-6-21/h7-14,21,25H,2-6,15-18H2,1H3/t25?,31-/m0/s1 | PDB
Reactome pathway
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| 29 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M3 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human)) | BDBM50092314
((1-Cyclohexyl-piperidin-4-yl)-[4-(4-methoxy-benzen...)Show SMILES COc1ccc(cc1)S(=O)(=O)c1ccc(cc1)C(=O)C1CCN(CC1)C1CCCCC1 Show InChI InChI=1S/C25H31NO4S/c1-30-22-9-13-24(14-10-22)31(28,29)23-11-7-19(8-12-23)25(27)20-15-17-26(18-16-20)21-5-3-2-4-6-21/h7-14,20-21H,2-6,15-18H2,1H3 | UniProtKB/SwissProt
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| 31 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M1 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M3
(Homo sapiens (Human)) | BDBM50451109
(CHEMBL2114064)Show SMILES COc1ccc(cc1)[S@@+]([O-])c1ccc(cc1)C(C#N)C1CCN(CC1)C1CCCCC1 |r| Show InChI InChI=1S/C26H32N2O2S/c1-30-23-9-13-25(14-10-23)31(29)24-11-7-20(8-12-24)26(19-27)21-15-17-28(18-16-21)22-5-3-2-4-6-22/h7-14,21-22,26H,2-6,15-18H2,1H3/t26?,31-/m0/s1 | PDB
Reactome pathway
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| 37 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M3 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
Muscarinic acetylcholine receptor M4
(Homo sapiens (Human)) | BDBM50451116
(CHEMBL2115126)Show SMILES COc1ccc(cc1)[S@+]([O-])c1ccc(cc1)C(C#N)C1CCN(CC1)C1CCCCC1 |r| Show InChI InChI=1S/C26H32N2O2S/c1-30-23-9-13-25(14-10-23)31(29)24-11-7-20(8-12-24)26(19-27)21-15-17-28(18-16-21)22-5-3-2-4-6-22/h7-14,21-22,26H,2-6,15-18H2,1H3/t26?,31-/m1/s1 | PDB
Reactome pathway
KEGG
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UniChem
Similars
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| 45 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute
Curated by ChEMBL
| Assay Description
Binding affinity against Muscarinic acetylcholine receptor M4 |
Bioorg Med Chem Lett 10: 2209-12 (2001)
BindingDB Entry DOI: 10.7270/Q24T6HMP |
More data for this
Ligand-Target Pair | |
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