Compound Detail
CHEMBL2370748
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Cc1ccc(C[C@@H](CN[C@@H](CCCN=C(N)N)C(=O)O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CO)NC(=O)[C@H](Cc2cccs2)NC(=O)CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H]2CCCN2C(=O)[C@@H](N)CCCN=C(N)N)cc1
Basic Information
| ChEMBL ID | CHEMBL2370748 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MKRUTYIUXYFOJF-HZAHPUDESA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
1082.3
MW (Da)
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.72
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| B2 bradykinin receptor CHEMBL3157 | Ki | 7.72 | 7.72 | 19.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| B2 bradykinin receptor | Ki | = | 19.0 | nM | 7.72 | Binding affinity towards human cloned Bradykinin receptor B2 expressed in CHO ce... | 10514289 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10514289 | 10.1021/jm9901531 | Homo sapiens | 2 |
| 10514289 | 10.1021/jm9901531 | B2 bradykinin receptor | 1 |
Data from ChEMBL 36 via Core Engine