Compound Detail
CHEMBL1791309
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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)N1Cc2cccc(NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CC(=O)O)c2N[C@@H](Cc2ccc(O)cc2)C1=O
Basic Information
| ChEMBL ID | CHEMBL1791309 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KTUBTCMWLDTEHO-AVXDUAIISA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
1050.2
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 8.59
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Type-2 angiotensin II receptor CHEMBL4607 | Ki | 8.59 | 7.76 | 2.6 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Type-2 angiotensin II receptor | Ki | = | 2.6 | nM | 8.59 | Displacement of [125I]-Ang II from angiotensin II receptor type 2 in pig uterus ... | 15943474 |
| Type-2 angiotensin II receptor | Ki | = | 117.4 | nM | 6.93 | Displacement of [125I]-Ang II from angiotensin II receptor type 2 in pig uterus ... | 15943474 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15943474 | 10.1021/jm0491492 | Angiotensin II receptor (AT-1) type-1 | 2 |
| 15943474 | 10.1021/jm0491492 | Type-2 angiotensin II receptor | 2 |
Data from ChEMBL 36 via Core Engine