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

CHEMBL287631

PROGABIDE
🧪 Phase II
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
🧪 Phase II
NC(=O)CCC/N=C(\c1ccc(Cl)cc1)c1cc(F)ccc1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL287631
Name PROGABIDE
Phase Phase II
Structure Type MOL
InChI Key IBALRBWGSVJPAP-HEHNFIMWSA-N
Active Moiety CHEMBL96

Known Names

Gabren Progabida Progabide SL 76 002 SL-76002
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
20
Publications
5
Known Names
1
Indications

Molecular Properties

334.8
MW (Da)
3.29
ALogP
3
HBA
2
HBD
75.7
PSA (Ų)
0.63
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral

Flags

Prodrug
USAN Stem -gab-
USAN Year 1984

Extended Properties

Molecular Formula C17H16ClFN2O2
MW 334.78
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -0.75

Indications

Epilepsy

ATC Classification

N03AG05
progabide
Level 1: NERVOUS SYSTEM
Level 2: ANTIEPILEPTICS

Activity Summary

Ki 2 meas. best 4.85

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
GABA-A receptor; anion channel
CHEMBL1907607
 Ki 4.85 4.85 14000.0 1
GABA-A receptor; anion channel
CHEMBL2093872
 Ki 4.4 4.4 40000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
GABA-A receptor; anion channel Ki = 14000.0 nM 4.85 Displacement of [3H]gamma-amino butyric acid from Gamma-aminobutyric acid (GABA-... 7392039
GABA-A receptor; anion channel Ki = 40000.0 nM 4.4 Displacement of [3H]gamma-amino butyric acid from Gamma-aminobutyric acid (GABA-... 7392039

Literature References

PubMed DOI Target Context # Activities
15646539 10.1016/s0399-8320(04)95062-2 Unchecked 11
15646539 10.1016/s0399-8320(04)95062-2 NON-PROTEIN TARGET 8
7392039 10.1021/jm00180a029 Mus musculus 4
37468498 10.1038/s41467-023-40064-9 Alpha-1A adrenergic receptor 3
2536440 10.1021/jm00122a025 Gamma-aminobutyric acid receptor subunit alpha-2 3
37468498 10.1038/s41467-023-40064-9 5-hydroxytryptamine receptor 2A 3
2724304 10.1021/jm00126a033 Mus musculus 3
37468498 10.1038/s41467-023-40064-9 Muscarinic acetylcholine receptor M2 2
37468498 10.1038/s41467-023-40064-9 Gamma-aminobutyric acid receptor subunit alpha-1 2
37468498 10.1038/s41467-023-40064-9 5-hydroxytryptamine receptor 2B 2
37468498 10.1038/s41467-023-40064-9 Beta-2 adrenergic receptor 2
37468498 10.1038/s41467-023-40064-9 Cannabinoid receptor 1 2
37468498 10.1038/s41467-023-40064-9 5-hydroxytryptamine receptor 1A 2
7392039 10.1021/jm00180a029 GABA-A receptor; anion channel 2
37468498 10.1038/s41467-023-40064-9 Progesterone receptor 2
2536440 10.1021/jm00122a025 Mus musculus 2
37468498 10.1038/s41467-023-40064-9 Alpha-2A adrenergic receptor 2
37468498 10.1038/s41467-023-40064-9 Voltage-dependent L-type calcium channel subunit alpha-1C 1
37468498 10.1038/s41467-023-40064-9 Voltage-gated inwardly rectifying potassium channel KCNH2 1
21055935 10.1016/j.bmcl.2010.10.068 No relevant target 1

Data from ChEMBL 36 via Core Engine