Compound Detail
CHEMBL437155
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C[C@@]12CCCC[C@]1(C)N(C(=O)[C@H]1Cc3ccccc3CN1C(=O)[C@H](CO)NC(=O)[C@H](Cc1cccs1)NC(=O)CNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)c1ccc(NC(N)C=N)cc1)[C@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)O)C2
Basic Information
| ChEMBL ID | CHEMBL437155 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SCDVIEZBCXPKAU-JPRIPFPXSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
1351.6
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 1 meas. best 9.58
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| B2 bradykinin receptor CHEMBL3157 | Kd | 9.58 | 9.58 | 0.3 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| B2 bradykinin receptor | Kd | = | 0.263 | nM | 9.58 | Antagonist effect against bradykinin B2 receptor was determined in rabbit jugula... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(01)80847-7 | B2 bradykinin receptor | 1 |
Data from ChEMBL 36 via Core Engine