Compound Detail
CHEMBL216386
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CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)O
Basic Information
| ChEMBL ID | CHEMBL216386 |
| Phase | Preclinical |
| Structure Type | BOTH |
| InChI Key | RDZJYRCUGADIDN-AXPLDACSSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
1119.3
MW (Da)
Drug Information
| Molecule Type | Protein |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 7.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Angiotensin-converting enzyme CHEMBL1808 | Ki | 7.0 | 7.0 | 100.0 | 1 |
| Renin CHEMBL286 | Ki | 6.1 | 6.1 | 800.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Angiotensin-converting enzyme | Ki | = | 100.0 | nM | 7.0 | Inhibitory activity against Angiotensin I converting enzyme | - |
| Renin | Ki | = | 800.0 | nM | 6.1 | Antihypertensive activity against human renin | 6267277 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 6267277 | 10.1021/jm00136a001 | Renin | 1 |
| - | 10.1016/S0960-894X(00)80669-1 | Angiotensin-converting enzyme | 1 |
Data from ChEMBL 36 via Core Engine