Compound Detail
CHEMBL4063272
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Basic Information
| ChEMBL ID | CHEMBL4063272 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QSBVJFRIAFKCRT-UHFFFAOYSA-N |
6
Targets
6
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
483.5
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 6 meas. best 5.81
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| RKO CHEMBL614879 | IC50 | 5.81 | 5.81 | 1540.0 | 1 |
| MDA-MB-231 CHEMBL400 | IC50 | 5.45 | 5.45 | 3550.0 | 1 |
| HepG2 CHEMBL395 | IC50 | 5.31 | 5.31 | 4890.0 | 1 |
| A549 CHEMBL392 | IC50 | 5.26 | 5.26 | 5520.0 | 1 |
| HCT-116 CHEMBL394 | IC50 | 5.21 | 5.21 | 6180.0 | 1 |
| LoVo CHEMBL614721 | IC50 | 5.07 | 5.07 | 8580.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| RKO | IC50 | = | 1540.0 | nM | 5.81 | Growth inhibition of human RKO cells after 48 hrs by MTT assay | 29509413 |
| MDA-MB-231 | IC50 | = | 3550.0 | nM | 5.45 | Growth inhibition of human MDA-MB-231 cells after 48 hrs by MTT assay | 29509413 |
| HepG2 | IC50 | = | 4890.0 | nM | 5.31 | Growth inhibition of human HepG2 cells after 48 hrs by MTT assay | 29509413 |
| A549 | IC50 | = | 5520.0 | nM | 5.26 | Growth inhibition of human A549 cells after 48 hrs by MTT assay | 29509413 |
| HCT-116 | IC50 | = | 6180.0 | nM | 5.21 | Growth inhibition of human HCT116 cells after 48 hrs by MTT assay | 29509413 |
| LoVo | IC50 | = | 8580.0 | nM | 5.07 | Growth inhibition of human LoVo cells after 48 hrs by MTT assay | 29509413 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29509413 | 10.1021/acs.jmedchem.8b00128 | RKO | 1 |
| 29509413 | 10.1021/acs.jmedchem.8b00128 | LoVo | 1 |
| 29509413 | 10.1021/acs.jmedchem.8b00128 | MDA-MB-231 | 1 |
| 29509413 | 10.1021/acs.jmedchem.8b00128 | HepG2 | 1 |
| 29509413 | 10.1021/acs.jmedchem.8b00128 | HCT-116 | 1 |
| 29509413 | 10.1021/acs.jmedchem.8b00128 | A549 | 1 |
Data from ChEMBL 36 via Core Engine