Compound Detail
CHEMBL4802051
RL2578 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
C=CC(=O)Nc1ccc2[nH]c(=O)n(C3CCN(Cc4ccc(-c5ccc6c(c5)NC(=O)CO6)cc4)CC3)c2c1
Basic Information
| ChEMBL ID | CHEMBL4802051 |
| Name | RL2578 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DHRJWFCFMBINAK-UHFFFAOYSA-N |
6
Targets
18
Activities
2
Assay Types
0
PK Parameters
20
Publications
0
Known Names
Molecular Properties
523.6
MW (Da)
4.29
ALogP
6
HBA
3
HBD
108.5
PSA (Ų)
0.33
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 11 meas. best 5.72
EC50 7 meas. best 5.46
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| RAC-alpha serine/threonine-protein kinase CHEMBL4282 | IC50 | 5.72 | 5.1375 | 1900.0 | 4 |
| Unchecked CHEMBL612545 | IC50 | 5.72 | 5.1833 | 1900.0 | 3 |
| Unchecked CHEMBL612545 | EC50 | 5.46 | 5.27 | 3500.0 | 3 |
| RAC-beta serine/threonine-protein kinase CHEMBL2431 | EC50 | 5.38 | 5.38 | 4200.0 | 1 |
| RAC-alpha serine/threonine-protein kinase CHEMBL4282 | EC50 | 5.38 | 5.38 | 4200.0 | 1 |
| ZR-75-1 CHEMBL614393 | EC50 | 5.38 | 5.38 | 4200.0 | 1 |
| RAC-beta serine/threonine-protein kinase CHEMBL2431 | IC50 | 5.08 | 4.915 | 8300.0 | 2 |
| AN3-CA CHEMBL1075392 | EC50 | 4.75 | 4.75 | 18000.0 | 1 |
| RAC-gamma serine/threonine-protein kinase CHEMBL4816 | IC50 | 4.75 | 4.75 | 18000.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.6019/CHEMBL5303300 | HEK-293T | 304 |
| - | 10.6019/CHEMBL5303300 | Fibroblast | 304 |
| - | 10.6019/CHEMBL5303300 | U2OS | 304 |
| - | 10.6019/CHEMBL5674860 | Colon cancer organoid | 12 |
| - | 10.6019/CHEMBL5724558 | Colon cancer organoid | 12 |
| - | 10.6019/CHEMBL5303304 | Fibroblast | 9 |
| - | 10.6019/CHEMBL5303304 | HEK-293T | 8 |
| - | 10.6019/CHEMBL5303304 | U2OS | 8 |
| - | 10.6019/CHEMBL4800730 | Unchecked | 6 |
| - | 10.6019/CHEMBL5608141 | Colon cancer organoid | 6 |
| - | 10.1158/2159-8290.CD-23-0050 | Colon cancer organoid | 5 |
| - | 10.6019/CHEMBL5444388 | RAC-alpha serine/threonine-protein kinase | 2 |
| - | 10.6019/CHEMBL5444388 | RAC-beta serine/threonine-protein kinase | 2 |
| - | 10.6019/CHEMBL5308504 | Casein kinase I isoform delta | 1 |
| - | 10.6019/CHEMBL5308504 | Peregrin | 1 |
| - | 10.6019/CHEMBL5308504 | Aurora kinase A | 1 |
| - | 10.6019/CHEMBL5308504 | Mitogen-activated protein kinase 1 | 1 |
| - | 10.6019/CHEMBL5308504 | Glycogen synthase kinase-3 beta | 1 |
| - | 10.6019/CHEMBL5308504 | Cyclin-dependent kinase 2 | 1 |
| - | 10.6019/CHEMBL4800730 | RAC-alpha serine/threonine-protein kinase | 1 |
Data from ChEMBL 36 via Core Engine