Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL2392362

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
COc1cccc(-c2ccnc(NCc3ccc(Cl)c(Cl)c3)n2)c1

Basic Information

ChEMBL ID CHEMBL2392362
Phase Preclinical
Structure Type MOL
InChI Key IOJVCHVCXVTROS-UHFFFAOYSA-N
3
Targets
5
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

360.2
MW (Da)
5.07
ALogP
4
HBA
1
HBD
47.0
PSA (Ų)
0.69
QED
1
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H15Cl2N3O
MW 360.24
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -1.47

Activity Summary

IC50 5 meas. best 5.43

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Dual specificity protein kinase CLK4
CHEMBL4203
IC50 5.43 5.42 3680.0 2
Dual specificity tyrosine-phosphorylation-regulated kinase 1A
CHEMBL2292
IC50 5.33 5.285 4654.0 2
Dual specificity protein kinase CLK1
CHEMBL4224
IC50 5.26 5.26 5459.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
23642479 10.1016/j.bmcl.2013.02.096 Dual specificity tyrosine-phosphorylation-regulated kinase 1A 2
23642479 10.1016/j.bmcl.2013.02.096 Dual specificity protein kinase CLK4 2
23642479 10.1016/j.bmcl.2013.02.096 Dual specificity protein kinase CLK2 1
23642479 10.1016/j.bmcl.2013.02.096 Dual specificity tyrosine-phosphorylation-regulated kinase 1B 1
23642479 10.1016/j.bmcl.2013.02.096 Dual specificity protein kinase CLK1 1

Data from ChEMBL 36 via Core Engine