Compound Detail
CHEMBL4207266
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Basic Information
| ChEMBL ID | CHEMBL4207266 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OSJXLDOVNXZNHD-LLVKDONJSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
406.4
MW (Da)
4.21
ALogP
4
HBA
2
HBD
94.5
PSA (Ų)
0.64
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Group 10 secretory phospholipase A2 CHEMBL4342 | IC50 | 6.7 | 6.7 | 200.0 | 1 |
| Phospholipase A2, membrane associated CHEMBL3474 | IC50 | 5.41 | 5.41 | 3900.0 | 1 |
| Phospholipase A2 group V CHEMBL4323 | IC50 | 5.07 | 5.07 | 8600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Group 10 secretory phospholipase A2 | IC50 | = | 200.0 | nM | 6.7 | Inhibition of sPLA2-10 (unknown origin) using 1-palmitoyl-2-oleoyl-sn-glycero-3-... | 30034586 |
| Phospholipase A2, membrane associated | IC50 | = | 3900.0 | nM | 5.41 | Inhibition of sPLA2-2A (unknown origin) using 1-palmitoyl-2-oleoyl-sn-glycero-3-... | 30034586 |
| Phospholipase A2 group V | IC50 | = | 8600.0 | nM | 5.07 | Inhibition of sPLA2-5 (unknown origin) using 1-palmitoyl-2-oleoyl-sn-glycero-3-p... | 30034586 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 30034586 | 10.1021/acsmedchemlett.7b00507 | Group 10 secretory phospholipase A2 | 2 |
| 30034586 | 10.1021/acsmedchemlett.7b00507 | Phospholipase A2, membrane associated | 1 |
| 30034586 | 10.1021/acsmedchemlett.7b00507 | Phospholipase A2 group V | 1 |
| 30034586 | 10.1021/acsmedchemlett.7b00507 | Mus musculus | 1 |
Data from ChEMBL 36 via Core Engine