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Compound Detail

CHEMBL590754

FILAMINAST
🧪 Phase II
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🧪 Phase II
COc1ccc(/C(C)=N/OC(N)=O)cc1OC1CCCC1

Basic Information

ChEMBL ID CHEMBL590754
Name FILAMINAST
Phase Phase II
Structure Type MOL
InChI Key STTRYQAGHGJXJJ-LICLKQGHSA-N

Known Names

Filaminast PDA-641 PDA641 WAY-PDA-641
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
2
Publications
4
Known Names

Molecular Properties

292.3
MW (Da)
2.84
ALogP
5
HBA
1
HBD
83.1
PSA (Ų)
0.51
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral

Flags

Natural Product
USAN Stem -ast
USAN Year 1996

Extended Properties

Molecular Formula C15H20N2O4
MW 292.34
Aromatic Rings 1
Heavy Atoms 21
NP-Likeness -0.15

Activity Summary

IC50 3 meas. best 6.02

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Mitogen-activated protein kinase 14
CHEMBL260
IC50 6.02 6.02 960.0 1
3',5'-cyclic-AMP phosphodiesterase 4B
CHEMBL275
IC50 6.02 6.02 960.0 1
3',5'-cyclic-AMP phosphodiesterase 4D
CHEMBL288
IC50 6.0 6.0 1000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
20188577 10.1016/j.bmc.2010.01.070 Mitogen-activated protein kinase 14 1
26908025 10.1021/acs.jmedchem.5b01813 3',5'-cyclic-AMP phosphodiesterase 4B 1

Data from ChEMBL 36 via Core Engine