Compound Detail
CHEMBL571729
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Basic Information
| ChEMBL ID | CHEMBL571729 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PNEUBIRKKLKPJD-ZHACJKMWSA-N |
3
Targets
4
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
280.4
MW (Da)
3.95
ALogP
3
HBA
1
HBD
42.0
PSA (Ų)
0.74
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 5.4
Target Activity Profile
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Fascin | IC50 | = | 4000.0 | nM | 5.4 | Inhibition of GST-tagged recombinant human fascin 1 expressed in Escherichia col... | - |
| Fascin | IC50 | = | 4000.0 | nM | 5.4 | Chemical Library Screens and Analysis: About 150,000 compounds were screened. Th... | - |
| Unchecked | IC50 | = | 4000.0 | nM | 5.4 | High Throughput Inhibition Assay: A high throughput assay was developed to scree... | - |
| 4T1 | IC50 | = | 60000.0 | nM | 4.22 | Antimigratory activity against mouse 4T1 cells assessed as inhibition of cell mi... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19853976 | 10.1016/j.ejmech.2009.09.037 | Mus musculus | 5 |
Data from ChEMBL 36 via Core Engine