Compound Detail
CHEMBL20489
OMPENACLID 🧪 Phase II
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🧪 Phase II
Basic Information
| ChEMBL ID | CHEMBL20489 |
| Name | OMPENACLID |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | KMXXSJLYVJEBHI-UHFFFAOYSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
13
Publications
10
Known Names
2
Indications
Molecular Properties
131.1
MW (Da)
-1.06
ALogP
2
HBA
4
HBD
99.2
PSA (Ų)
0.29
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Indications
Neoplasms Colorectal Neoplasms
Activity Summary
IC50 1 meas. best 5.75
Ki 1 meas.
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| GABA-A receptor; anion channel CHEMBL1907607 | IC50 | 5.75 | 5.75 | 1800.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| GABA-A receptor; anion channel | IC50 | = | 1800.0 | nM | 5.75 | Inhibition of [3H]GABA binding to Gamma-aminobutyric acid A (GABA-A) receptor of... | 3027337 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11312923 | 10.1021/jm000094n | Mus musculus | 8 |
| 21955456 | 10.1016/j.bmc.2011.08.058 | Proton-coupled amino acid transporter 1 | 2 |
| - | 10.6019/CHEMBL4495565 | SARS-CoV-2 | 2 |
| - | 10.6019/CHEMBL4808148 | Histone deacetylase 6 | 2 |
| 11312923 | 10.1021/jm000094n | Unchecked | 1 |
| 11312923 | 10.1021/jm000094n | Creatine kinase M-type | 1 |
| 11312922 | 10.1021/jm000095f | Unchecked | 1 |
| 11312922 | 10.1021/jm000095f | A10 | 1 |
| 11312922 | 10.1021/jm000095f | Creatine kinase M-type | 1 |
| 3027337 | 10.1021/jm00385a003 | GABA-A receptor; anion channel | 1 |
| 15745817 | 10.1016/j.bmcl.2005.01.048 | Tryptase beta-1 | 1 |
| - | 10.21203/rs.3.rs-23951/v1 | SARS-CoV-2 | 1 |
| - | 10.6019/CHEMBL4495564 | Replicase polyprotein 1ab | 1 |
Data from ChEMBL 36 via Core Engine