Compound Detail
CHEMBL1372855
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Basic Information
| ChEMBL ID | CHEMBL1372855 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SLHLSAOQHYXDAQ-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
280.4
MW (Da)
3.47
ALogP
2
HBA
1
HBD
32.3
PSA (Ų)
0.93
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.22
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 5.22 | 5.22 | 6030.0 | 1 |
| Nuclear receptor subfamily 4immunitygroup A member 1 CHEMBL1293229 | IC50 | 4.51 | 4.51 | 31182.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 6030.0 | nM | 5.22 | PubChem BioAssay. Dose Response confirmation of small molecule inhibitors origin... | - |
| Nuclear receptor subfamily 4immunitygroup A member 1 | IC50 | = | 31182.0 | nM | 4.51 | PUBCHEM_BIOASSAY: High Throughput Fluorescence Polarization Screen for Bcl-B Phe... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22480197 | 10.1021/jm2007694 | Nucleic Acid | 1 |
| - | 10.6019/CHEMBL3301361 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine