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Compound Detail

CHEMBL277294

PHTHALIMIDE
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O=C1NC(=O)c2ccccc21

Basic Information

ChEMBL ID CHEMBL277294
Name PHTHALIMIDE
Phase Preclinical
Structure Type MOL
InChI Key XKJCHHZQLQNZHY-UHFFFAOYSA-N
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
16
Publications
0
Known Names

Molecular Properties

147.1
MW (Da)
0.57
ALogP
2
HBA
1
HBD
46.2
PSA (Ų)
0.55
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H5NO2
MW 147.13
Aromatic Rings 1
Heavy Atoms 11
NP-Likeness -0.33

Activity Summary

IC50 3 meas. best 4.69

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Glycogen synthase kinase-3 beta
CHEMBL262
IC50 4.69 4.69 20220.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
30996781 10.1021/acsmedchemlett.8b00507 SH-SY5Y 5
6737419 10.1021/jm00372a011 Mus musculus 3
6131131 10.1021/jm00356a022 Mus musculus 3
6827542 10.1021/jm00356a023 Mus musculus 3
3965717 10.1021/jm00379a003 Mus musculus 3
30996781 10.1021/acsmedchemlett.8b00507 Microglia 3
17378546 10.1021/jm061471k Unchecked 2
30996781 10.1021/acsmedchemlett.8b00507 Glycogen synthase kinase-3 beta 2
12873507 10.1016/s0960-894x(03)00535-3 Unchecked 1
17378546 10.1021/jm061471k Liver carboxylesterase 1 1
21778064 10.1016/j.bmc.2011.06.070 Amine oxidase [flavin-containing] A 1
21778064 10.1016/j.bmc.2011.06.070 Amine oxidase [flavin-containing] B 1
30996781 10.1021/acsmedchemlett.8b00507 Histone deacetylase 1 1
30996781 10.1021/acsmedchemlett.8b00507 Histone deacetylase 6 1
30996781 10.1021/acsmedchemlett.8b00507 Histone deacetylase 1
30996781 10.1021/acsmedchemlett.8b00507 Cerebellar granule neurone 1

Data from ChEMBL 36 via Core Engine