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 | |
|---|---|---|---|---|
| ▸ | SRD5A2 | P31213 | 2/20 | 0.77 |
| ▸ | RARB | P10826 | 1/20 | 0.69 |
| ▸ | RARG | P13631 | 1/20 | 0.69 |
| ▸ | NR1H4 | Q96RI1 | 4/20 | 0.65 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.65 |
| ▸ | DAO | P14920 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.59 |
| ▸ | MAPT | P10636 | 1/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.59 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.59 |
| ▸ | RXRA | P19793 | 3/20 | 0.58 |
| ▸ | RXRB | P28702 | 3/20 | 0.58 |
| ▸ | RXRG | P48443 | 1/20 | 0.58 |
| ▸ | CES2 | O00748 | 1/20 | 0.58 |
| ▸ | CES1 | P23141 | 1/20 | 0.58 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.57 |
| ▸ | CA1 | P00915 | 1/20 | 0.57 |
| ▸ | CA2 | P00918 | 1/20 | 0.57 |
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 SCHEMBL11549239 | 0.98 | SRD5A2 (0.74) | SRD5A2RARBRARGNR1H4EPHX2 | |
| Benzophenone SCHEMBL9499396 | 0.94 | SRD5A2 (0.89) | SRD5A2RARBRARGNR1H4EPHX2 | |
| Tert-Butylbenzene SCHEMBL31465191 | 0.93 | SRD5A2 (0.67) | SRD5A2RARBRARGNR1H4EPHX2 | |
| SCHEMBL36693 | 0.93 | SRD5A2 (0.87) | SRD5A2RARBRARGNR1H4EPHX2 | |
| SCHEMBL9120613 | 0.91 | SRD5A2 (0.83) | SRD5A2RARBRARGNR1H4EPHX2 | |
| Methane SCHEMBL10959139 | 0.91 | SRD5A2 (0.83) | SRD5A2RARBRARGNR1H4EPHX2 | |
| SCHEMBL9269555 | 0.91 | SRD5A2 (0.83) | SRD5A2RARBRARGNR1H4EPHX2 | |
| SCHEMBL592353 | 0.91 | SRD5A2 (0.83) | SRD5A2RARBRARGNR1H4EPHX2 | |
| SCHEMBL205291 | 0.91 | SRD5A2 (0.83) | SRD5A2RARBRARGNR1H4EPHX2 | |
| Ammonia Solution, Strong SCHEMBL3842685 | 0.91 | SRD5A2 (0.83) | SRD5A2RARBRARGNR1H4EPHX2 |
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-0273766-B1 | Polyvinyl chloride molding powder | SUMITOMO CHEMICAL CO (JP) | 1995-03-08 | — | — | EP | claimed |
| CN-103525279-A | Iron oxide red antirust primer | DANYANG YONGSHENG PAINT CO LTD | 2014-01-22 | — | — | CN | disclosed |