Compound Detail
CHEMBL266730
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CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCN=C(N)N)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)[C@@H](C)CC
Basic Information
| ChEMBL ID | CHEMBL266730 |
| Phase | Preclinical |
| Structure Type | BOTH |
| InChI Key | XUMWSIBVXUHJKM-NGXXPKEMSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
2262.6
MW (Da)
Drug Information
| Molecule Type | Protein |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 8.51
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Neuropeptide Y receptor type 2 CHEMBL4018 | Ki | 8.51 | 8.51 | 3.1 | 1 |
| Neuropeptide Y receptor type 1 CHEMBL4777 | Ki | 6.8 | 6.8 | 160.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Neuropeptide Y receptor type 2 | Ki | = | 3.1 | nM | 8.51 | Tested against neuropeptide Y2 receptors using SK-N-BE2 human neuroblastoma cell... | 8426366 |
| Neuropeptide Y receptor type 1 | Ki | = | 160.0 | nM | 6.8 | Tested against neuropeptide Y1 receptors using SK-N-MC human neuroblastoma cells | 8426366 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8426366 | 10.1021/jm00055a010 | Neuropeptide Y receptor type 1 | 1 |
| 8426366 | 10.1021/jm00055a010 | Neuropeptide Y receptor type 2 | 1 |
Data from ChEMBL 36 via Core Engine