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Compound Detail

CHEMBL149082

TRAMIPROSATE
🧪 Phase III
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🧪 Phase III
NCCCS(=O)(=O)O

Basic Information

ChEMBL ID CHEMBL149082
Name TRAMIPROSATE
Phase Phase III
Structure Type MOL
InChI Key SNKZJIOFVMKAOJ-UHFFFAOYSA-N

Known Names

3-aminopropane sulfonic acid Acamprosate related compound a Homotaurine NC-531 NC-758 NSC-77071 Tramiprosate Tramiprosato
3
Targets
5
Activities
2
Assay Types
1
PK Parameters
15
Publications
8
Known Names
1
Indications
1
Mechanisms

Molecular Properties

139.2
MW (Da)
-0.78
ALogP
3
HBA
2
HBD
80.4
PSA (Ų)
0.50
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral

Flags

Natural Product
USAN Year 2005

Extended Properties

Molecular Formula C3H9NO3S
MW 139.18
Aromatic Rings 0
Heavy Atoms 8
NP-Likeness 0.47

Mechanism of Action

Mechanism Action Type Target Direct Efficacy
Amyloid-beta A4 protein stabiliser STABILISER Amyloid-beta precursor protein

Indications

Alzheimer Disease

Activity Summary

IC50 4 meas. best 6.52
Ki 1 meas.

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
GABA-A receptor; anion channel
CHEMBL1907607
IC50 6.52 6.52 300.0 1
GABA B receptor
CHEMBL2111474
IC50 5.7 5.11 2000.0 2
Amyloid-beta precursor protein
CHEMBL2487
IC50 4.0 4.0 100000.0 1

Pharmacokinetic Data

Parameter Value Units Species
T1/2 9.0 hr Homo sapiens

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
23601707 10.1016/j.bmcl.2013.02.104 Rattus norvegicus 13
- 10.6019/CHEMBL4495565 SARS-CoV-2 4
- 10.1016/0960-894X(96)00307-1 Cavia porcellus 2
21955456 10.1016/j.bmc.2011.08.058 Proton-coupled amino acid transporter 1 2
27687671 10.1016/j.bmcl.2016.09.009 CDGSH iron-sulfur domain-containing protein 1 2
- 10.6019/CHEMBL4495564 Replicase polyprotein 1ab 2
- 10.6019/CHEMBL4808148 Histone deacetylase 6 2
- 10.1016/S0960-894X(01)81218-X GABA B receptor 1
- 10.1016/0960-894X(96)00307-1 GABA B receptor 1
- 10.1016/0960-894X(96)00307-1 GABA-A receptor; anion channel 1
23601707 10.1016/j.bmcl.2013.02.104 Mus musculus 1
23601707 10.1016/j.bmcl.2013.02.104 Voltage-gated inwardly rectifying potassium channel KCNH2 1
23484434 10.1021/jm3017317 Amyloid-beta precursor protein 1
- 10.21203/rs.3.rs-23951/v1 SARS-CoV-2 1
35841881 10.1016/j.ejmech.2022.114578 ADMET 1

Data from ChEMBL 36 via Core Engine