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Compound Detail

CHEMBL4760869

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C=CC(=O)Nc1ccccc1C(=O)Nc1n[nH]c2cc(-c3ccc(OC)cc3)ccc12

Basic Information

ChEMBL ID CHEMBL4760869
Phase Preclinical
Structure Type MOL
InChI Key WUYPMJJFXQNSHK-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

412.4
MW (Da)
4.62
ALogP
4
HBA
3
HBD
96.1
PSA (Ų)
0.40
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H20N4O3
MW 412.45
Aromatic Rings 4
Heavy Atoms 31
NP-Likeness -1.00

Activity Summary

IC50 1 meas. best 6.2

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Fibroblast growth factor receptor 4
CHEMBL3973
IC50 6.2 6.2 632.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Fibroblast growth factor receptor 4 IC50 = 632.0 nM 6.2 Inhibition of FGFR4 (unknown origin) 33618175

Literature References

PubMed DOI Target Context # Activities
33618175 10.1016/j.ejmech.2021.113219 Fibroblast growth factor receptor 1 1
33618175 10.1016/j.ejmech.2021.113219 Fibroblast growth factor receptor 4 1

Data from ChEMBL 36 via Core Engine