Compound Detail
CHEMBL3659483
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
Basic Information
| ChEMBL ID | CHEMBL3659483 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XZDCCRWIGKXYPP-QHCPKHFHSA-N |
1
Targets
4
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
383.4
MW (Da)
5.10
ALogP
3
HBA
1
HBD
58.2
PSA (Ų)
0.52
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.62
Ki 2 meas. best 7.23
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutaminyl-peptide cyclotransferase CHEMBL4508 | Ki | 7.23 | 7.23 | 58.8 | 2 |
| Glutaminyl-peptide cyclotransferase CHEMBL4508 | IC50 | 6.62 | 6.62 | 240.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutaminyl-peptide cyclotransferase | Ki | = | 58.8 | nM | 7.23 | Spectrophotometic Assay: Spectrophotometic Assay: This novel assay was used to d... | - |
| Glutaminyl-peptide cyclotransferase | Ki | = | 58.8 | nM | 7.23 | Fluorometric Assay: All measurements were performed with a BioAssay Reader HTS-7... | - |
| Glutaminyl-peptide cyclotransferase | IC50 | = | 240.0 | nM | 6.62 | Spectrophotometic Assay: Spectrophotometic Assay: This novel assay was used to d... | - |
| Glutaminyl-peptide cyclotransferase | IC50 | = | 240.0 | nM | 6.62 | Fluorometric Assay: All measurements were performed with a BioAssay Reader HTS-7... | - |
Data from ChEMBL 36 via Core Engine