Compound Detail
CHEMBL2409553
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Basic Information
| ChEMBL ID | CHEMBL2409553 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KAXFQBKENUGFCF-UHFFFAOYSA-N |
5
Targets
5
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
353.3
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 5 meas. best 8.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| MCF7 CHEMBL387 | IC50 | 8.0 | 8.0 | 10.0 | 1 |
| PC-3 CHEMBL390 | IC50 | 7.1 | 7.1 | 80.0 | 1 |
| HT-29 CHEMBL384 | IC50 | 6.55 | 6.55 | 280.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 6.21 | 6.21 | 620.0 | 1 |
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 6.17 | 6.17 | 680.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| MCF7 | IC50 | = | 10.0 | nM | 8.0 | Cytotoxicity against human MCF7 cells after 96 hrs by sulforhodamine B assay | 23810282 |
| PC-3 | IC50 | = | 80.0 | nM | 7.1 | Cytotoxicity against human PC3 cells after 48 hrs by sulforhodamine B assay | 23810282 |
| HT-29 | IC50 | = | 280.0 | nM | 6.55 | Cytotoxicity against human HT-29 cells after 48 hrs by sulforhodamine B assay | 23810282 |
| Unchecked | IC50 | = | 620.0 | nM | 6.21 | Inhibition of bovine brain tubulin polymerization incubated for 15 mins prior to... | 23810282 |
| NON-PROTEIN TARGET | IC50 | = | 680.0 | nM | 6.17 | Cytotoxicity against human 786 cells after 48 hrs by sulforhodamine B assay | 23810282 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23810282 | 10.1016/j.bmcl.2013.06.009 | Unchecked | 3 |
| 23810282 | 10.1016/j.bmcl.2013.06.009 | MCF7 | 1 |
| 23810282 | 10.1016/j.bmcl.2013.06.009 | NON-PROTEIN TARGET | 1 |
| 23810282 | 10.1016/j.bmcl.2013.06.009 | HT-29 | 1 |
| 23810282 | 10.1016/j.bmcl.2013.06.009 | PC-3 | 1 |
Data from ChEMBL 36 via Core Engine