Compound Detail
CHEMBL4287478
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 | CHEMBL4287478 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CZZMLALOKXNFIA-IPELMVKDSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
343.4
MW (Da)
5.08
ALogP
1
HBA
1
HBD
29.1
PSA (Ų)
0.82
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 6.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Voltage-gated potassium channel, KQT; KCNQ2(Kv7.2)/KCNQ3(Kv7.3) CHEMBL2221348 | EC50 | 6.7 | 6.7 | 200.0 | 1 |
| Voltage-gated potassium channel KCNQ3/KCNQ5 CHEMBL3883311 | EC50 | 6.4 | 6.4 | 400.0 | 1 |
| Potassium voltage-gated channel subfamily KQT member 4 CHEMBL3576 | EC50 | 5.4 | 5.4 | 4000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Voltage-gated potassium channel, KQT; KCNQ2(Kv7.2)/KCNQ3(Kv7.3) | EC50 | = | 200.0 | nM | 6.7 | Activation of human Kv7.2/7.3 by patch clamp method | 30327146 |
| Voltage-gated potassium channel KCNQ3/KCNQ5 | EC50 | = | 400.0 | nM | 6.4 | Activation of human Kv7.3/7.5 by patch clamp method | 30327146 |
| Potassium voltage-gated channel subfamily KQT member 4 | EC50 | = | 4000.0 | nM | 5.4 | Activation of human Kv7.4 by patch clamp method | 30327146 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 30327146 | 10.1016/j.bmcl.2018.09.036 | Voltage-gated potassium channel, KQT; KCNQ2(Kv7.2)/KCNQ3(Kv7.3) | 2 |
| 30327146 | 10.1016/j.bmcl.2018.09.036 | No relevant target | 1 |
| 30327146 | 10.1016/j.bmcl.2018.09.036 | Voltage-gated potassium channel KCNQ3/KCNQ5 | 1 |
| 30327146 | 10.1016/j.bmcl.2018.09.036 | Potassium voltage-gated channel subfamily KQT member 4 | 1 |
| 30327146 | 10.1016/j.bmcl.2018.09.036 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine