Compound Detail
CHEMBL263598
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CC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CS)C(=O)NCc1ccccc1)C(c1ccccc1)c1ccccc1
Basic Information
| ChEMBL ID | CHEMBL263598 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ACPKTBUAADMPRF-JNLIVQRCSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
1002.2
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hepatitis C virus serine protease, NS3/NS4A CHEMBL2095231 | IC50 | 6.6 | 6.6 | 250.0 | 1 |
| Hepatitis C virus CHEMBL379 | IC50 | 6.6 | 6.6 | 250.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hepatitis C virus serine protease, NS3/NS4A | IC50 | = | 250.0 | nM | 6.6 | Inhibitory activity against Hepatitis C NS3/NS4A protease | 12540231 |
| Hepatitis C virus | IC50 | = | 250.0 | nM | 6.6 | Antiviral activity against Hepatitis C virus | 19112024 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12540231 | 10.1021/jm025594q | Hepatitis C virus serine protease, NS3/NS4A | 1 |
| 19112024 | 10.1016/j.bmc.2008.11.075 | Hepatitis C virus | 1 |
Data from ChEMBL 36 via Core Engine