Assay Detail
Functional
CHEMBL4809036
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Reduction of propionyl-CoA in human hepatocytes derived from propionic acidemia patient pretreated for 30 mins followed by 13C-isoleucine addition and measured after 1 hr by MS/MS analysis
30
Total Activities
30
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Functional |
| Organism | Homo sapiens |
| Cell Type | Hepatocyte |
| Confidence | 0 — Uncurated / Unknown |
| Curated By | Autocuration |
Publication
Identification of 2,2-Dimethylbutanoic Acid (HST5040), a Clinical Development Candidate for the Treatment of Propionic Acidemia and Methylmalonic Acidemia.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| EC50 | 30 | 5.15 | 6.12 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL4871957 | — | — | 1 | 6.12 |
| CHEMBL1232385 | T-BUTYLACETIC ACID | — | 1 | 6.04 |
| CHEMBL286013 | DIMEBUTIC ACID | 2.0 | 1 | 6.03 |
| CHEMBL4866386 | — | — | 1 | 5.91 |
| CHEMBL4873476 | — | — | 1 | 5.76 |
| CHEMBL4867017 | — | — | 1 | 5.57 |
| CHEMBL322719 | PIVALATE | — | 1 | 5.26 |
| CHEMBL4868765 | — | — | 1 | 5.18 |
| CHEMBL4851445 | — | — | 1 | 5.00 |
| CHEMBL109 | VALPROIC ACID | 4.0 | 1 | 4.93 |
| CHEMBL1902018 | — | — | 1 | 4.91 |
| CHEMBL1204680 | — | — | 1 | 4.90 |
| CHEMBL4854573 | — | — | 1 | 4.81 |
| CHEMBL4866078 | — | — | 1 | 4.72 |
| CHEMBL4649900 | CYCLOPROPANE CARBOXYLIC ACID | — | 1 | 4.63 |
| CHEMBL184290 | — | — | 1 | 4.47 |
| CHEMBL1160012 | — | — | 1 | 4.28 |
| CHEMBL3560137 | — | — | 1 | 4.26 |
| CHEMBL186602 | — | — | 1 | - |
| CHEMBL170070 | — | — | 1 | - |
| CHEMBL3358702 | — | — | 1 | - |
| CHEMBL4867734 | — | — | 1 | - |
| CHEMBL4861714 | — | — | 1 | - |
| CHEMBL4857473 | — | — | 1 | - |
| CHEMBL4878490 | — | — | 1 | - |
| CHEMBL4865041 | — | — | 1 | - |
| CHEMBL1469 | PHENYLBUTANOIC ACID | 4.0 | 1 | - |
| CHEMBL851 | PHENYL PROPIONIC ACID | — | 1 | - |
| CHEMBL1044 | PHENYLACETIC ACID | -1.0 | 1 | - |
| CHEMBL4873436 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL4871957 | — | EC50 | = | 760.0 | nM | 6.12 |
| CHEMBL1232385 | T-BUTYLACETIC ACID | EC50 | = | 910.0 | nM | 6.04 |
| CHEMBL286013 | DIMEBUTIC ACID | EC50 | = | 940.0 | nM | 6.03 |
| CHEMBL4866386 | — | EC50 | = | 1230.0 | nM | 5.91 |
| CHEMBL4873476 | — | EC50 | = | 1730.0 | nM | 5.76 |
| CHEMBL4867017 | — | EC50 | = | 2690.0 | nM | 5.57 |
| CHEMBL322719 | PIVALATE | EC50 | = | 5530.0 | nM | 5.26 |
| CHEMBL4868765 | — | EC50 | = | 6550.0 | nM | 5.18 |
| CHEMBL4851445 | — | EC50 | = | 9910.0 | nM | 5.00 |
| CHEMBL109 | VALPROIC ACID | EC50 | = | 11730.0 | nM | 4.93 |
| CHEMBL1902018 | — | EC50 | = | 12280.0 | nM | 4.91 |
| CHEMBL1204680 | — | EC50 | = | 12590.0 | nM | 4.90 |
| CHEMBL4854573 | — | EC50 | = | 15480.0 | nM | 4.81 |
| CHEMBL4866078 | — | EC50 | = | 18950.0 | nM | 4.72 |
| CHEMBL4649900 | CYCLOPROPANE CARBOXYLIC ACID | EC50 | = | 23270.0 | nM | 4.63 |
| CHEMBL184290 | — | EC50 | = | 33740.0 | nM | 4.47 |
| CHEMBL1160012 | — | EC50 | = | 52140.0 | nM | 4.28 |
| CHEMBL3560137 | — | EC50 | = | 55370.0 | nM | 4.26 |
| CHEMBL186602 | — | EC50 | > | 100000.0 | nM | - |
| CHEMBL170070 | — | EC50 | > | 100000.0 | nM | - |
| CHEMBL3358702 | — | EC50 | - | — | - | |
| CHEMBL4867734 | — | EC50 | - | — | - | |
| CHEMBL4861714 | — | EC50 | > | 100000.0 | nM | - |
| CHEMBL4857473 | — | EC50 | - | — | - | |
| CHEMBL4878490 | — | EC50 | - | — | - | |
| CHEMBL4865041 | — | EC50 | - | — | - | |
| CHEMBL1469 | PHENYLBUTANOIC ACID | EC50 | - | — | - | |
| CHEMBL851 | PHENYL PROPIONIC ACID | EC50 | - | — | - | |
| CHEMBL1044 | PHENYLACETIC ACID | EC50 | - | — | - | |
| CHEMBL4873436 | — | EC50 | - | — | - |