Compound Detail
CHEMBL55427
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
N#Cc1ccc(Cn2cncc2CNc2ccc(-c3cccc(C(=O)O)c3)c(-c3ccccc3)c2)cc1
Basic Information
| ChEMBL ID | CHEMBL55427 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LANNGAZONSVWID-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
484.6
MW (Da)
6.45
ALogP
5
HBA
2
HBD
90.9
PSA (Ų)
0.26
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.37
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Protein farnesyltransferase CHEMBL2094108 | IC50 | 6.37 | 6.37 | 430.0 | 1 |
| Geranylgeranyl transferase type I CHEMBL2095164 | IC50 | 5.36 | 5.36 | 4400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Protein farnesyltransferase | IC50 | = | 430.0 | nM | 6.37 | Inhibition of farnesyltransferase from human Burkitt lymphoma (Daudi) cells | 11754590 |
| Geranylgeranyl transferase type I | IC50 | = | 4400.0 | nM | 5.36 | Inhibition of partially purified Geranylgeranyl transferase type I (GGTase-I) fr... | 11754590 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11754590 | 10.1021/jm0103099 | Protein farnesyltransferase | 1 |
| 11754590 | 10.1021/jm0103099 | Geranylgeranyl transferase type I | 1 |
Data from ChEMBL 36 via Core Engine