Compound Detail
CHEMBL1791267
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CC[C@@H](C)[C@@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)N1CCC(CNC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CC(=O)O)=C[C@@H](Cc2ccc(O)cc2)C1=O
Basic Information
| ChEMBL ID | CHEMBL1791267 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YAKOGQZWPRMVPT-FTTCMKFLSA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
1013.2
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.08
IC50 1 meas. best 8.55
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Angiotensin II receptor (AT-1) type-1 CHEMBL2094250 | IC50 | 8.55 | 8.55 | 2.8 | 1 |
| Oryctolagus cuniculus CHEMBL374 | EC50 | 6.08 | 6.08 | 830.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Angiotensin II receptor (AT-1) type-1 | IC50 | = | 2.8 | nM | 8.55 | Inhibitory concentration against [125 I]Ang II binding to rat pituitary membrane... | 9083479 |
| Oryctolagus cuniculus | EC50 | = | 830.0 | nM | 6.08 | Concentration which produces 50% of maximal contractile response at rabbit aorta... | 9083479 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9083479 | 10.1021/jm960553d | Angiotensin II receptor (AT-1) type-1 | 1 |
| 9083479 | 10.1021/jm960553d | Oryctolagus cuniculus | 1 |
Data from ChEMBL 36 via Core Engine