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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.63 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.63 |
| ▸ | POLB | P06746 | 5/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.58 |
| ▸ | RECQL | P46063 | 1/20 | 0.58 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.58 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.57 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1640414 | 0.95 | TDP1 (0.68) | TDP1MAPK1POLBL3MBTL1RECQL | |
| SCHEMBL8923884 | 0.84 | TDP1 (0.62) | TDP1MAPK1POLBL3MBTL1RECQL | |
| SCHEMBL10036470 | 0.83 | TDP1 (0.66) | TDP1MAPK1POLBL3MBTL1RECQL | |
| Benzoic Acid SCHEMBL29002940 | 0.83 | ALDH1A1 (0.54) | TDP1MAPK1POLBL3MBTL1RECQL | |
| SCHEMBL13264390 | 0.81 | ALDH1A1 (0.61) | TDP1MAPK1POLBL3MBTL1RECQL | |
| Benzoic Acid SCHEMBL28643026 | 0.78 | TSHR (0.55) | TDP1POLBL3MBTL1RECQLESR2 | |
| SCHEMBL6443452 | 0.78 | ALDH1A1 (0.70) | TDP1MAPK1POLBL3MBTL1RECQL | |
| SCHEMBL16690062 | 0.78 | TDP1 (0.67) | TDP1MAPK1POLBL3MBTL1ALDH1A1 | |
| SCHEMBL27939896 | 0.77 | TDP1 (0.58) | TDP1MAPK1POLBL3MBTL1ALDH1A1 | |
| SCHEMBL13433782 | 0.77 | TDP1 (0.58) | TDP1MAPK1POLBL3MBTL1RECQL |
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 |
|---|---|---|---|---|---|---|---|
| EP-2741731-A1 | ENCAPSULATES | The Procter and Gamble Company (US) | 2014-06-18 | — | — | EP | disclosed |
| WO-2013022949-A1 | ENCAPSULATES | THE PROCTER & GAMBLE COMPANY (US) | 2013-02-14 | — | — | WO | disclosed |
| WO-2012085864-A1 | ENCAPSULATES | PROCTER & GAMBLE INTERNATIONAL OPERATIONS SA (CH) | 2012-06-28 | — | — | WO | disclosed |