Compound Detail
CHEMBL328126
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 | CHEMBL328126 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JIQRYIXFQANSEL-UHFFFAOYSA-N |
4
Targets
8
Activities
1
Assay Types
0
PK Parameters
7
Publications
0
Known Names
Molecular Properties
348.8
MW (Da)
6.20
ALogP
1
HBA
1
HBD
28.7
PSA (Ų)
0.47
QED
1
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 8 meas. best 7.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glucagon receptor CHEMBL1985 | IC50 | 7.1 | 6.2875 | 80.0 | 4 |
| Glucagon receptor CHEMBL4773 | IC50 | 6.7 | 6.7 | 200.0 | 1 |
| Mitogen-activated protein kinase 14 CHEMBL260 | IC50 | 5.85 | 5.85 | 1400.0 | 2 |
| Mitogen-activated protein kinase 14 CHEMBL4825 | IC50 | 5.85 | 5.85 | 1400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glucagon receptor | IC50 | = | 80.0 | nM | 7.1 | Binding affinity determined by reduction in binding of 125 I-glucagon to the hum... | 10201821 |
| Glucagon receptor | IC50 | = | 200.0 | nM | 6.7 | Binding affinity towards glucagon receptor determined by reduction in binding of... | 10201821 |
| Glucagon receptor | IC50 | = | 800.0 | nM | 6.1 | Binding affinity towards glucagon receptor determined by reduction in binding of... | 10201821 |
| Glucagon receptor | IC50 | = | 800.0 | nM | 6.1 | Antagonist activity against glucagon receptor | 16250656 |
| Mitogen-activated protein kinase 14 | IC50 | = | 1400.0 | nM | 5.85 | Inhibitory potency evaluated against rat p38 kinase | 9873604 |
| Mitogen-activated protein kinase 14 | IC50 | = | 1400.0 | nM | 5.85 | Inhibitory activity against p38-alpha kinase | 10201821 |
| Mitogen-activated protein kinase 14 | IC50 | = | 1400.0 | nM | 5.85 | Inhibitory activity against Mitogen-activated protein kinase 14, p38-alpha | 16250656 |
| Glucagon receptor | IC50 | = | 1402.81 | nM | 5.85 | Antagonist activity at human glucagon receptor | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10201821 | 10.1016/s0960-894x(99)00081-5 | Glucagon receptor | 4 |
| 9873604 | 10.1016/s0960-894x(98)00495-8 | Mitogen-activated protein kinase 14 | 1 |
| 10201821 | 10.1016/s0960-894x(99)00081-5 | Mitogen-activated protein kinase 14 | 1 |
| 10201821 | 10.1016/s0960-894x(99)00081-5 | Unchecked | 1 |
| 16250656 | 10.1021/jm050563r | Glucagon receptor | 1 |
| 16250656 | 10.1021/jm050563r | Mitogen-activated protein kinase 14 | 1 |
| - | 10.1007/s00044-013-0801-3 | Glucagon receptor | 1 |
Data from ChEMBL 36 via Core Engine