Compound Detail
CHEMBL4634333
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Cc1scc2c1N(C(=O)CN1CCN(CCCCCCCCCCNC(=O)Cc3ccc4c(c3)C(C)(C)C3=C5C=C6C7=[N+](CCC6OC5CCN34)c3ccc(S(=O)(=O)[O-])cc3C7(C)C)CC1)c1ccccc1NC2=O
Basic Information
| ChEMBL ID | CHEMBL4634333 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IXAIIFCFPQJBJF-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
1054.4
MW (Da)
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 10.5
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 CHEMBL216 | Ki | 10.5 | 10.45 | 0.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 | Ki | = | 0.03162 | nM | 10.5 | Displacement of [3H]NMS from human recombinant muscarinic receptor M1 expressed ... | 33479678 |
| Muscarinic acetylcholine receptor M1 | Ki | = | 0.03981 | nM | 10.4 | Displacement of [3H]NMS from human recombinant muscarinic receptor M2 expressed ... | 33479678 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33479678 | 10.1039/d0md00137f | Muscarinic acetylcholine receptor M1 | 2 |
| 32233403 | 10.1021/acs.jmedchem.9b02172 | Muscarinic acetylcholine receptor M1 | 1 |
| 32233403 | 10.1021/acs.jmedchem.9b02172 | Muscarinic acetylcholine receptor M2 | 1 |
Data from ChEMBL 36 via Core Engine