Compound Detail
CHEMBL37132
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL37132 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OJXBNCYNASEZSC-VIFPVBQESA-N |
3
Targets
6
Activities
1
Assay Types
0
PK Parameters
8
Publications
0
Known Names
Molecular Properties
209.2
MW (Da)
0.80
ALogP
4
HBA
0
HBD
47.4
PSA (Ų)
0.74
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 6 meas. best 7.37
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor CHEMBL1907609 | IC50 | 7.37 | 6.4733 | 43.0 | 3 |
| Muscarinic acetylcholine receptor M1 CHEMBL276 | IC50 | 6.54 | 5.72 | 288.0 | 2 |
| Muscarinic acetylcholine receptor M2 CHEMBL309 | IC50 | 4.51 | 4.51 | 30910.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor | IC50 | = | 43.0 | nM | 7.37 | Compound was evaluated for its ability to displace muscarinic agonist [3H]quinuc... | - |
| Muscarinic acetylcholine receptor | IC50 | = | 100.0 | nM | 7.0 | Ability to displace [3H]cis--2-methyl-5-((dimethylamino)methyl)-1,3-di oxolane f... | 1732522 |
| Muscarinic acetylcholine receptor M1 | IC50 | = | 288.0 | nM | 6.54 | Ability to displace [3H]pirenzepine (pir) from muscarinic acetylcholine receptor... | 1732522 |
| Muscarinic acetylcholine receptor | IC50 | = | 8900.0 | nM | 5.05 | Compound was evaluated for its ability to displace muscarinic antagonist [3H]cis... | - |
| Muscarinic acetylcholine receptor M1 | IC50 | = | 12690.0 | nM | 4.9 | Compound was evaluated for the displacement of the muscarinic QNB in a genetical... | - |
| Muscarinic acetylcholine receptor M2 | IC50 | = | 30910.0 | nM | 4.51 | Compound was evaluated for the displacement of the muscarinic QNB in rat heart h... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 1732522 | 10.1021/jm00079a002 | Muscarinic acetylcholine receptor M1 | 4 |
| 1732522 | 10.1021/jm00079a002 | Muscarinic acetylcholine receptor | 3 |
| 1732522 | 10.1021/jm00079a002 | Muscarinic acetylcholine receptor M3 | 2 |
| - | 10.1016/S0960-894X(01)80787-3 | Muscarinic acetylcholine receptor | 2 |
| - | 10.1016/S0960-894X(01)80787-3 | Muscarinic acetylcholine receptor M2 | 2 |
| - | 10.1016/S0960-894X(01)80787-3 | Unchecked | 1 |
| - | 10.1016/S0960-894X(01)80787-3 | SK-N-SH | 1 |
| - | 10.1016/S0960-894X(01)80787-3 | Muscarinic acetylcholine receptor M1 | 1 |
Data from ChEMBL 36 via Core Engine