Compound Detail
CHEMBL1455497
MALIC ACID 🧪 Phase II
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🧪 Phase II
Basic Information
| ChEMBL ID | CHEMBL1455497 |
| Name | MALIC ACID |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | BJEPYKJPYRNKOW-UHFFFAOYSA-N |
| Therapeutic | ✓ Yes |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
17
Publications
24
Known Names
Molecular Properties
134.1
MW (Da)
-1.09
ALogP
3
HBA
3
HBD
94.8
PSA (Ų)
0.46
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Racemic |
Activity Summary
IC50 1 meas. best 4.01
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 4.01 | 4.01 | 97700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 97700.0 | nM | 4.01 | Antioxidant activity assessed as inhibition of ferrous chloride-induced lipid pe... | 28885836 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.6019/CHEMBL4808148 | Histone deacetylase 6 | 2 |
| - | 10.6019/CHEMBL4495565 | SARS-CoV-2 | 2 |
| - | 10.6019/CHEMBL4651402 | SARS-CoV-2 | 2 |
| 38128237 | 10.1016/j.ejmech.2023.116058 | Unchecked | 1 |
| 23136941 | 10.1021/jf3038874 | Meloidogyne incognita | 1 |
| 34792334 | 10.1021/acs.jmedchem.1c01694 | Prolyl hydroxylase EGLN3 | 1 |
| 34792334 | 10.1021/acs.jmedchem.1c01694 | Egl nine homolog 1 | 1 |
| 34792334 | 10.1021/acs.jmedchem.1c01694 | Prolyl hydroxylase EGLN2 | 1 |
| 34792334 | 10.1021/acs.jmedchem.1c01694 | Hypoxia-inducible factor 1-alpha inhibitor | 1 |
| 34792334 | 10.1021/acs.jmedchem.1c01694 | Alpha-ketoglutarate-dependent dioxygenase FTO | 1 |
| - | 10.6019/CHEMBL4495564 | Replicase polyprotein 1ab | 1 |
| - | 10.1101/2020.04.21.054387 | SARS-CoV-2 | 1 |
| - | 10.21203/rs.3.rs-23951/v1 | SARS-CoV-2 | 1 |
| 28885836 | 10.1021/acs.jnatprod.7b00322 | Unchecked | 1 |
| 23547775 | 10.1021/jm400193d | Alpha-ketoglutarate-dependent dioxygenase FTO | 1 |
| 23234607 | 10.1021/jm301583m | Egl nine homolog 1 | 1 |
| 23234607 | 10.1021/jm301583m | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine