Compound Detail
CHEMBL268351
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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(C)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](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)C1CCCCC1)C1CCCCC1
Basic Information
| ChEMBL ID | CHEMBL268351 |
| Phase | Preclinical |
| Structure Type | BOTH |
| InChI Key | VXKJDJXYEUSNAZ-WMXVFIPBSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
1727.0
MW (Da)
Drug Information
| Molecule Type | Protein |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 8.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Neuropeptide Y receptor type 2 CHEMBL4018 | IC50 | 8.52 | 8.31 | 3.0 | 2 |
| Neuropeptide Y receptor type 1 CHEMBL4777 | IC50 | 4.58 | 4.58 | 26000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Neuropeptide Y receptor type 2 | IC50 | = | 3.0 | nM | 8.52 | Compound was evaluated for its inhibitory activity against human neuropeptide Y2... | - |
| Neuropeptide Y receptor type 2 | IC50 | = | 8.0 | nM | 8.1 | Compound was evaluated for its inhibitory activity against Y2 receptor of rabbit... | - |
| Neuropeptide Y receptor type 1 | IC50 | = | 26000.0 | nM | 4.58 | Compound was evaluated for its inhibitory activity against human neuropeptide Y1... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(00)80696-4 | Neuropeptide Y receptor type 2 | 2 |
| - | 10.1016/S0960-894X(00)80696-4 | Neuropeptide Y receptor type 1 | 1 |
Data from ChEMBL 36 via Core Engine