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 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | HPGD | P15428 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.41 |
| ▸ | STAT3 | P40763 | 1/20 | 0.40 |
| ▸ | STAT1 | P42224 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | GLA | P06280 | 2/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.38 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.38 |
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 SCHEMBL1249516 | 0.98 | DAO (0.48) | DAOTSHRNAPRTALDH1A1KDM4E | |
| Benzoic Acid SCHEMBL28410519 | 0.98 | DAO (0.48) | DAOTSHRNAPRTALDH1A1KDM4E | |
| Benzoic Acid SCHEMBL4657369 | 0.98 | DAO (0.48) | DAOTSHRNAPRTALDH1A1KDM4E | |
| Benzoic Acid SCHEMBL1361627 | 0.97 | DAO (0.47) | DAOTSHRNAPRTALDH1A1KDM4E | |
| Benzoic Acid SCHEMBL28157733 | 0.97 | DAO (0.47) | DAOTSHRNAPRTALDH1A1KDM4E | |
| Benzoic Acid SCHEMBL5161411 | 0.97 | DAO (0.47) | DAOTSHRNAPRTALDH1A1KDM4E | |
| Benzoic Acid SCHEMBL17687656 | 0.97 | DAO (0.47) | DAOTSHRNAPRTALDH1A1KDM4E | |
| Terephthalic Acid SCHEMBL28411701 | 0.91 | TSHR (0.44) | TSHRALDH1A1KDM4EHPGDKMT2A | |
| Terephthalic Acid SCHEMBL28411703 | 0.91 | TSHR (0.44) | TSHRALDH1A1KDM4EHPGDKMT2A | |
| SCHEMBL29090785 | 0.89 | EGFR (0.49) | ALDH1A1KDM4EHPGDKMT2ANPC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117120629-A | Chemical compositions and methods of use thereof | 纳米线科技公司 | 2023-11-24 | — | — | CN | disclosed |