Compound Detail
CHEMBL2037236
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Basic Information
| ChEMBL ID | CHEMBL2037236 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DQZXYBWDQNXAPY-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
2
PK Parameters
4
Publications
0
Known Names
Molecular Properties
284.3
MW (Da)
2.11
ALogP
5
HBA
0
HBD
44.0
PSA (Ų)
0.74
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.63
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Regulator of G-protein signaling 4 CHEMBL1795091 | IC50 | 7.63 | 7.63 | 23.5 | 1 |
| Regulator of G-protein signaling 8 CHEMBL2034803 | IC50 | 5.25 | 5.25 | 5600.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| Cmax | 2430.0 | nM | - |
| Cmax | 2380.0 | nM | - |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Regulator of G-protein signaling 4 | IC50 | = | 23.5 | nM | 7.63 | Inhibition of RGS4 interaction with Galpha0 protein by flow cytometry protein in... | 22368763 |
| Regulator of G-protein signaling 8 | IC50 | = | 5600.0 | nM | 5.25 | Inhibition of RGS8 interaction with Galpha0 protein by flow cytometry protein in... | 22368763 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29133036 | 10.1016/j.ejmech.2017.10.068 | No relevant target | 4 |
| 22368763 | 10.1021/ml200263y | Regulator of G-protein signaling 4 | 1 |
| 22368763 | 10.1021/ml200263y | Regulator of G-protein signaling 8 | 1 |
| 22368763 | 10.1021/ml200263y | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine