Compound Detail
CHEMBL3393876
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CCCCCCCCCCCCCCCCNC(=O)CN(CC(N)=O)C(=O)CCCCCNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS/C(=C\S(=O)(=O)C(C)(C)C)S(=O)(=O)C(C)(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](NC(=O)CNC(=O)CO)[C@@H](C)O)C(c1ccccc1)c1ccccc1
Basic Information
| ChEMBL ID | CHEMBL3393876 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XPWYHNYAECWSTG-YAEVVNKOSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
1985.6
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 8.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Ferroportin CHEMBL3392948 | EC50 | 8.0 | 8.0 | 10.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Ferroportin | EC50 | = | 10.0 | nM | 8.0 | Induction of human ferroportin degradation expressed in HEK293 cells after 24 hr... | 25599838 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25599838 | 10.1016/j.bmcl.2014.12.094 | Ferroportin | 1 |
Data from ChEMBL 36 via Core Engine