Compound Detail
CHEMBL1489294
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Basic Information
| ChEMBL ID | CHEMBL1489294 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OYMZSGKOYWWZDC-UHFFFAOYSA-N |
3
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
303.2
MW (Da)
5.08
ALogP
2
HBA
0
HBD
25.8
PSA (Ų)
0.62
QED
1
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 6.43
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 6.43 | 5.895 | 373.5 | 2 |
| DNA damage-inducible transcript 3 protein CHEMBL2146304 | IC50 | 5.68 | 5.68 | 2080.0 | 1 |
| X-box-binding protein 1 CHEMBL1741176 | IC50 | 5.28 | 5.28 | 5220.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 373.47 | nM | 6.43 | PUBCHEM_BIOASSAY: Luminescence-based dose response cell-based high throughput sc... | - |
| DNA damage-inducible transcript 3 protein | IC50 | = | 2080.0 | nM | 5.68 | PUBCHEM_BIOASSAY: CHOP dose-response primary assay. (Class of assay: confirmator... | - |
| Unchecked | IC50 | = | 4398.0 | nM | 5.36 | PUBCHEM_BIOASSAY: High Throughput Screen to Identify Inhibitors of Mycobacterium... | - |
| X-box-binding protein 1 | IC50 | = | 5220.0 | nM | 5.28 | PUBCHEM_BIOASSAY: XBP1 DR counterscreen for CHOP. (Class of assay: confirmatory)... | - |
Data from ChEMBL 36 via Core Engine