Compound Detail
CHEMBL103741
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 | CHEMBL103741 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YUNAWRDISADKIN-UHFFFAOYSA-N |
2
Targets
4
Activities
2
Assay Types
0
PK Parameters
11
Publications
0
Known Names
Molecular Properties
213.3
MW (Da)
0.16
ALogP
4
HBA
1
HBD
62.3
PSA (Ų)
0.72
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 4.66
Kd 1 meas. best 5.01
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate receptor 2 CHEMBL4016 | Kd | 5.01 | 5.01 | 9800.0 | 1 |
| Unchecked CHEMBL612545 | EC50 | 4.66 | 4.66 | 22000.0 | 1 |
| Glutamate receptor 2 CHEMBL4016 | EC50 | 4.3 | 4.3 | 50582.5 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate receptor 2 | Kd | = | 9800.0 | nM | 5.01 | Binding affinity to GluA2-LBD-L483Y-N754S complex (unknown origin) by isothermal... | 25375781 |
| Unchecked | EC50 | = | 22000.0 | nM | 4.66 | Activity at Wistar rat cortex AMPA receptor expressed in Xenopus laevis oocytes ... | 17552506 |
| Glutamate receptor 2 | EC50 | = | 50582.47 | nM | 4.3 | Positive allosteric modulation of GluA2 (Q) flop isoform (unknown origin) expres... | 29256599 |
| Glutamate receptor 2 | EC50 | = | 50600.0 | nM | 4.3 | Positive allosteric modulation of GluA2 (Q) flop isoform (unknown origin) expres... | 29256599 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17552506 | 10.1021/jm070120i | Unchecked | 4 |
| 9685234 | 10.1021/jm970694v | Rattus norvegicus | 3 |
| 18980844 | 10.1016/j.bmc.2008.10.036 | Unchecked | 3 |
| 9685234 | 10.1021/jm970694v | Glutamate receptor ionotropic, AMPA | 2 |
| 20108934 | 10.1021/jm901495t | Oocyte | 2 |
| 29256599 | 10.1021/acs.jmedchem.7b01323 | Glutamate receptor 2 | 2 |
| 9685234 | 10.1021/jm970694v | Unchecked | 1 |
| 17552506 | 10.1021/jm070120i | Hippocampus | 1 |
| 18980844 | 10.1016/j.bmc.2008.10.036 | No relevant target | 1 |
| 20839777 | 10.1021/jm1000419 | Unchecked | 1 |
| 25375781 | 10.1021/jm501268r | Glutamate receptor 2 | 1 |
Data from ChEMBL 36 via Core Engine