Compound Detail
CHEMBL410230
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CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Basic Information
| ChEMBL ID | CHEMBL410230 |
| Phase | Preclinical |
| Structure Type | BOTH |
| InChI Key | WTMDVOVPFQSBHG-MPJXNKHJSA-N |
2
Targets
4
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
1093.2
MW (Da)
Drug Information
| Molecule Type | Protein |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 7.66
Ki 2 meas. best 6.96
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cavia porcellus CHEMBL369 | EC50 | 7.66 | 7.19 | 22.0 | 2 |
| Mus musculus CHEMBL375 | Ki | 6.96 | 6.96 | 110.0 | 1 |
| Cavia porcellus CHEMBL369 | Ki | 6.41 | 6.41 | 390.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cavia porcellus | EC50 | = | 22.0 | nM | 7.66 | Agonist activity by measuring the effect on amylase secretion from guinea pig ac... | 2452253 |
| Mus musculus | Ki | = | 110.0 | nM | 6.96 | Potency in displacing [3H]propionyl-CCK-8 from mouse brain membranes. | 2452253 |
| Cavia porcellus | EC50 | = | 190.0 | nM | 6.72 | Agonist activity by measuring the ability to stimulate the contraction of the is... | 2452253 |
| Cavia porcellus | Ki | = | 390.0 | nM | 6.41 | Potency in displacing [3H]Boc(Nle28,Nle31)-CCk27-33 from guinea pig pancreatic a... | 2452253 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 2452253 | 10.1021/jm00400a013 | Cavia porcellus | 3 |
| 2452253 | 10.1021/jm00400a013 | Mus musculus | 1 |
Data from ChEMBL 36 via Core Engine