Compound Detail
CHEMBL3314694
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Basic Information
| ChEMBL ID | CHEMBL3314694 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IYMIPGFVFBAPOK-UHFFFAOYSA-N |
2
Targets
5
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
344.1
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 5 meas. best 4.89
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 4.89 | 4.62 | 13000.0 | 4 |
| HT-29 CHEMBL384 | IC50 | 4.43 | 4.43 | 37000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| NON-PROTEIN TARGET | IC50 | = | 13000.0 | nM | 4.89 | Cytotoxicity against human HL60 cells after 48 hrs by MTT assay | 24961641 |
| NON-PROTEIN TARGET | IC50 | = | 27000.0 | nM | 4.57 | Cytotoxicity against human OVCAR5 cells after 48 hrs by MTT assay | 24961641 |
| NON-PROTEIN TARGET | IC50 | = | 29000.0 | nM | 4.54 | Cytotoxicity against human PC3 cells after 48 hrs by MTT assay | 24961641 |
| NON-PROTEIN TARGET | IC50 | = | 33000.0 | nM | 4.48 | Cytotoxicity against human 786-O cells after 48 hrs by MTT assay | 24961641 |
| HT-29 | IC50 | = | 37000.0 | nM | 4.43 | Cytotoxicity against human HT-29 cells after 48 hrs by MTT assay | 24961641 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24961641 | 10.1016/j.bmcl.2014.05.075 | NON-PROTEIN TARGET | 4 |
| 24961641 | 10.1016/j.bmcl.2014.05.075 | HT-29 | 1 |
Data from ChEMBL 36 via Core Engine