Compound Detail
CHEMBL268815
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CC[C@@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)N[C@@H](Cc1ccc(N)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)O
Basic Information
| ChEMBL ID | CHEMBL268815 |
| Phase | Preclinical |
| Structure Type | BOTH |
| InChI Key | WXEDXHQFMNILKZ-CTGIVLKDSA-N |
1
Targets
4
Activities
1
Assay Types
0
PK Parameters
8
Publications
0
Known Names
Molecular Properties
1071.2
MW (Da)
Drug Information
| Molecule Type | Protein |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 4 meas. best 9.15
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Type-2 angiotensin II receptor CHEMBL4607 | Ki | 9.15 | 8.9325 | 0.7 | 4 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Type-2 angiotensin II receptor | Ki | = | 0.7 | nM | 9.15 | Displacement of [125I]Ang2 from AT2 receptor in pig uterus myometrium | 17004728 |
| Type-2 angiotensin II receptor | Ki | = | 0.9 | nM | 9.05 | Displacement of [125I]-Ang II from angiotensin II receptor type 2 in pig uterus ... | 15943474 |
| Type-2 angiotensin II receptor | Ki | = | 1.4 | nM | 8.85 | Displacement of [125I]-Ang II from pig uterus myometrium angiotensin II type 2 (... | 15537355 |
| Type-2 angiotensin II receptor | Ki | = | 2.1 | nM | 8.68 | Binding affinity for Angiotensin II receptor type 2 using [125I]- Ang II in pig ... | 14761188 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 14761188 | 10.1021/jm030921v | Angiotensin II receptor (AT-1) type-1 | 1 |
| 14761188 | 10.1021/jm030921v | Type-2 angiotensin II receptor | 1 |
| 15537355 | 10.1021/jm049651m | Angiotensin II receptor (AT-1) type-1 | 1 |
| 15537355 | 10.1021/jm049651m | Type-2 angiotensin II receptor | 1 |
| 15943474 | 10.1021/jm0491492 | Angiotensin II receptor (AT-1) type-1 | 1 |
| 15943474 | 10.1021/jm0491492 | Type-2 angiotensin II receptor | 1 |
| 17004728 | 10.1021/jm051222g | Angiotensin II receptor (AT-1) type-1 | 1 |
| 17004728 | 10.1021/jm051222g | Type-2 angiotensin II receptor | 1 |
Data from ChEMBL 36 via Core Engine