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 | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CES2 | O00748 | 2/20 | 0.39 |
| ▸ | CES1 | P23141 | 2/20 | 0.39 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Benzoic Acid SCHEMBL5081312 | 0.94 | TSHR (0.50) | DAOTSHRNAPRTALDH1A1RAB9A | |
| Benzoic Acid SCHEMBL1073076 | 0.94 | TSHR (0.50) | DAOTSHRNAPRTALDH1A1RAB9A | |
| Benzoic Acid SCHEMBL28058177 | 0.89 | DAO (0.45) | DAOTSHRNAPRTALDH1A1RAB9A | |
| Benzoic Acid SCHEMBL27642143 | 0.85 | TRPA1 (0.43) | DAOTSHRNAPRTALDH1A1RAB9A | |
| Benzoic Acid SCHEMBL27623024 | 0.84 | DAO (0.47) | DAOTSHRNAPRTALDH1A1RAB9A | |
| SCHEMBL1478232 | 0.83 | THRB (0.40) | MAPTHTR2AHRH1MAPK1 | |
| SCHEMBL6229980 | 0.83 | THRB (0.40) | MAPTHTR2AHRH1MAPK1 | |
| Benzoic Acid SCHEMBL27899369 | 0.83 | DAO (0.45) | DAOTSHRNAPRTALDH1A1RAB9A | |
| Benzoic Acid SCHEMBL27522265 | 0.82 | TRPA1 (0.40) | DAOTSHRNAPRTALDH1A1RAB9A | |
| Benzoic Acid SCHEMBL29104326 | 0.82 | DAO (0.48) | DAOTSHRNAPRTALDH1A1RAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0442178-A1 | Hot plastisol compositions | ASTER, Inc. (US) | 1991-08-21 | — | — | EP | claimed |
| WO-2023095825-A1 | VINYL CHLORIDE-BASED PASTE RESIN AND RESIN COMPOSITION FOR AUTOMOBILE UNDERCOATING | 株式会社カネカ | 2023-06-01 | — | — | WO | disclosed |