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

CHEMBL5403540

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
CC1=NN(c2ccc(C(=O)O)cc2)C(=O)/C1=C(/C)c1ccc[nH]1

Basic Information

ChEMBL ID CHEMBL5403540
Phase Preclinical
Structure Type MOL
InChI Key JEYNWVMZLGKQHY-GDNBJRDFSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

309.3
MW (Da)
2.91
ALogP
3
HBA
2
HBD
85.8
PSA (Ų)
0.85
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H15N3O3
MW 309.33
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -0.88

Activity Summary

IC50 1 meas. best 4.71

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Histone acetyltransferase KAT8
CHEMBL1932912
IC50 4.71 4.71 19400.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
37155735 10.1021/acs.jmedchem.2c01937 Histone acetyltransferase KAT8 1
37155735 10.1021/acs.jmedchem.2c01937 Histone acetyltransferase p300 1
37155735 10.1021/acs.jmedchem.2c01937 Histone acetyltransferase KAT2B 1

Data from ChEMBL 36 via Core Engine