Compound Detail
CHEMBL2440763
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CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnc(C(=O)NCCCC(O)(P(=O)(O)O)P(=O)(O)O)cn1)B(O)O
Basic Information
| ChEMBL ID | CHEMBL2440763 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FZLLYUHJRJSDPI-PXNSSMCTSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
659.3
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.12
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 8.12 | 8.12 | 7.6 | 1 |
| RPMI-8226 CHEMBL614882 | IC50 | 7.99 | 7.99 | 10.2 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| NON-PROTEIN TARGET | IC50 | = | 7.59 | nM | 8.12 | Cytotoxicity against mouse 5TGM1 cells after 48 to 72 hrs by SRB assay | 24119559 |
| RPMI-8226 | IC50 | = | 10.18 | nM | 7.99 | Cytotoxicity against human RPMI8226 cells after 48 to 72 hrs by SRB assay | 24119559 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24119559 | 10.1016/j.bmcl.2013.09.043 | RPMI-8226 | 2 |
| 24119559 | 10.1016/j.bmcl.2013.09.043 | NON-PROTEIN TARGET | 2 |
Data from ChEMBL 36 via Core Engine