Known targets — ChEMBL curated mechanism
CACNA1CCACNA1DCACNA1FCACNA1SDPP4HTR1BHTR1D
The experimentally established mechanism targets of Benzoic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 13/20 | 0.78 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | USP2 | O75604 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | PLEC | Q15149 | 1/20 | 0.44 |
| ▸ | MIF | P14174 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | SNCA | P37840 | 1/20 | 0.39 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8066 | 0.88 | APP (1.00) | APPCYP1A2USP2MEN1POLB | |
| Acetic Acid SCHEMBL233000 | 0.87 | APP (0.86) | APPCYP1A2USP2MEN1POLB | |
| SCHEMBL7113427 | 0.87 | APP (0.97) | APPCYP1A2USP2MEN1POLB | |
| SCHEMBL29456578 | 0.87 | APP (0.97) | APPCYP1A2USP2MEN1POLB | |
| Ammonia Solution, Strong SCHEMBL29419058 | 0.87 | APP (0.97) | APPCYP1A2USP2MEN1POLB | |
| SCHEMBL1095367 | 0.87 | APP (0.97) | APPCYP1A2USP2MEN1POLB | |
| SCHEMBL9538200 | 0.84 | APP (0.68) | APPCYP1A2MEN1POLBKMT2A | |
| Propionic Acid SCHEMBL21043901 | 0.84 | APP (0.80) | APPCYP1A2USP2MEN1POLB | |
| Propionic Acid SCHEMBL21043899 | 0.84 | APP (0.80) | APPCYP1A2USP2MEN1POLB | |
| Bromoacetic Acid SCHEMBL1896727 | 0.84 | APP (0.80) | APPCYP1A2USP2MEN1POLB |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11519014-B2 | Specific substrate of an ALDH isoenzyme | ADVANCED BIODESIGN (FR) | 2022-12-06 | — | — | US | disclosed |
| US-20190233871-A1 | SPECIFIC SUBSTRATE OF AN ALDH ISOENZYME | ADVANCED BIODESIGN (FR) | 2019-08-01 | — | — | US | disclosed |
| EP-3491143-A1 | SPECIFIC SUBSTRATE OF AN ALDH ISOENZYME | Advanced Biodesign (FR) | 2019-06-05 | — | — | EP | disclosed |