Compound Detail
CHEMBL475627
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Basic Information
| ChEMBL ID | CHEMBL475627 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NCPMGOXPOHLXNY-UHFFFAOYSA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
319.4
MW (Da)
4.43
ALogP
5
HBA
0
HBD
47.9
PSA (Ų)
0.56
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.07
IC50 1 meas. best 5.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Nucleic Acid CHEMBL345 | EC50 | 6.07 | 6.07 | 860.0 | 1 |
| 1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase gamma-2 CHEMBL4100 | IC50 | 5.4 | 5.4 | 4000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Nucleic Acid | EC50 | = | 860.0 | nM | 6.07 | PUBCHEM_BIOASSAY: Luminescent HTS for small molecule inhibitors of MT1-MMP trans... | - |
| 1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase gamma-2 | IC50 | = | 4000.0 | nM | 5.4 | Inhibition of recombinant phospholipase C gamma2 expressed in baculovirus infect... | 19303309 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19303309 | 10.1016/j.bmc.2009.02.049 | 1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase gamma-2 | 2 |
| - | 10.6019/CHEMBL4495565 | SARS-CoV-2 | 2 |
| - | 10.6019/CHEMBL4495564 | Replicase polyprotein 1ab | 1 |
Data from ChEMBL 36 via Core Engine