Compound Detail
CHEMBL269267
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
CC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)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(N)=O)[C@@H](C)O)C(C)C
Basic Information
| ChEMBL ID | CHEMBL269267 |
| Phase | Preclinical |
| Structure Type | BOTH |
| InChI Key | NDQIPMDOGHILHE-UXUJTPOBSA-N |
3
Targets
5
Activities
3
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
1931.2
MW (Da)
Drug Information
| Molecule Type | Protein |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 9.04
Ki 2 meas. best 8.05
EC50 1 meas. best 7.89
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Neuropeptide Y receptor type 2 CHEMBL3309 | IC50 | 9.04 | 9.04 | 0.9 | 1 |
| Neuropeptide Y receptor type 2 CHEMBL4018 | IC50 | 8.89 | 8.89 | 1.3 | 1 |
| Neuropeptide Y receptor type 2 CHEMBL4018 | Ki | 8.05 | 8.05 | 9.0 | 1 |
| Neuropeptide Y receptor type 2 CHEMBL4018 | EC50 | 7.89 | 7.89 | 13.0 | 1 |
| Neuropeptide Y receptor type 1 CHEMBL4777 | Ki | 6.93 | 6.93 | 118.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Neuropeptide Y receptor type 2 | IC50 | = | 0.91 | nM | 9.04 | Antisecretory potency, affinity for intestinal PYY of rat jejunum by using short... | 10978189 |
| Neuropeptide Y receptor type 2 | IC50 | = | 1.3 | nM | 8.89 | Affinity against Neuropeptide Y receptor Y2 in SK-N-BE2 cell line | 10978189 |
| Neuropeptide Y receptor type 2 | Ki | = | 9.0 | nM | 8.05 | Displacement of human [125I]PYY from NPY2 receptor expressed in human KAN-TS cel... | 17055726 |
| Neuropeptide Y receptor type 2 | EC50 | = | 13.0 | nM | 7.89 | Agonist activity at human NPY2 receptor expressed in human KAN-TS cells by [35S]... | 17055726 |
| Neuropeptide Y receptor type 1 | Ki | = | 118.0 | nM | 6.93 | Displacement of [125I]PYY from NPY1 receptor expressed in human SK-N-MC cells | 17055726 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10978189 | 10.1021/jm000052z | Neuropeptide Y receptor type 2 | 2 |
| 17055726 | 10.1016/j.bmcl.2006.10.007 | Neuropeptide Y receptor type 2 | 2 |
| 10978189 | 10.1021/jm000052z | Neuropeptide Y receptor type 1 | 1 |
| 17055726 | 10.1016/j.bmcl.2006.10.007 | Neuropeptide Y receptor type 1 | 1 |
| 17055726 | 10.1016/j.bmcl.2006.10.007 | Neuropeptide Y receptor type 5 | 1 |
Data from ChEMBL 36 via Core Engine