Compound Detail
CHEMBL1076603
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CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(C(=O)c2ccccc2)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)O
Basic Information
| ChEMBL ID | CHEMBL1076603 |
| Phase | Preclinical |
| Structure Type | BOTH |
| InChI Key | PXNIGPMZOUUXMA-FSKISDTGSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
1154.3
MW (Da)
Drug Information
| Molecule Type | Protein |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 9.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Type-1 angiotensin II receptor CHEMBL227 | Ki | 9.4 | 9.275 | 0.4 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Type-1 angiotensin II receptor | Ki | = | 0.4 | nM | 9.4 | Displacement of [125I][Sar1,Ile8]Ang2 from human AT1 receptor N111G constitutive... | 20146480 |
| Type-1 angiotensin II receptor | Ki | = | 0.7 | nM | 9.15 | Displacement of [125I][Sar1,Ile8]Ang2 from wild-type human AT1 receptor expresse... | 20146480 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20146480 | 10.1021/jm9015747 | Type-1 angiotensin II receptor | 4 |
Data from ChEMBL 36 via Core Engine