Compound Detail
CHEMBL415157
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CCCCCCCCCCCCCCCC(=O)Oc1ccc(C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)CNC)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N2CCC[C@H]2C(=O)N[C@H](Cc2ccccc2)C(=O)O)C(C)C)cc1
Basic Information
| ChEMBL ID | CHEMBL415157 |
| Phase | Preclinical |
| Structure Type | BOTH |
| InChI Key | WXGWAOQHVDSCOS-YZFAQSRRSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
1226.6
MW (Da)
Drug Information
| Molecule Type | Protein |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 2 meas. best 8.45
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Type-1 angiotensin II receptor CHEMBL3374 | Kd | 8.45 | 8.45 | 3.5 | 1 |
| Type-1 angiotensin II receptor CHEMBL3948 | Kd | 7.44 | 7.44 | 36.3 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Type-1 angiotensin II receptor | Kd | = | 3.548 | nM | 8.45 | Dissociation constant for [125 I] Ang binding to type 1 Angiotensin II receptor ... | 9379447 |
| Type-1 angiotensin II receptor | Kd | = | 36.31 | nM | 7.44 | Negative log of the dose of antagonist (compound) that reduces response of a dou... | 9379447 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9379447 | 10.1021/jm9608669 | Type-1 angiotensin II receptor | 3 |
| 9379447 | 10.1021/jm9608669 | Oryctolagus cuniculus | 1 |
Data from ChEMBL 36 via Core Engine