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 | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.61 |
| ▸ | DAO | P14920 | 1/20 | 0.61 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.61 |
| ▸ | SRD5A2 | P31213 | 3/20 | 0.52 |
| ▸ | CES1 | P23141 | 2/20 | 0.52 |
| ▸ | CES2 | O00748 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.44 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.44 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.44 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
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 SCHEMBL818565 | 1.00 | TSHR (0.61) | TSHRDAONAPRTSRD5A2CES1 | |
| Benzoic Acid SCHEMBL148714 | 1.00 | TSHR (0.61) | TSHRDAONAPRTSRD5A2CES1 | |
| Triethylene Glycol SCHEMBL28076076 | 0.98 | TSHR (0.58) | TSHRDAONAPRTSRD5A2CES1 | |
| Triethylene Glycol SCHEMBL2112665 | 0.98 | TSHR (0.58) | TSHRDAONAPRTSRD5A2CES1 | |
| Pentaethylene Glycol SCHEMBL8622527 | 0.98 | TSHR (0.58) | TSHRDAONAPRTSRD5A2CES1 | |
| Tetraethylene Glycol SCHEMBL9137599 | 0.98 | TSHR (0.58) | TSHRDAONAPRTSRD5A2CES1 | |
| Triethylene Glycol SCHEMBL2442859 | 0.98 | TSHR (0.58) | TSHRDAONAPRTSRD5A2CES1 | |
| Triethylene Glycol SCHEMBL205789 | 0.98 | TSHR (0.58) | TSHRDAONAPRTSRD5A2CES1 | |
| Triethylene Glycol SCHEMBL5730892 | 0.98 | TSHR (0.58) | TSHRDAONAPRTSRD5A2CES1 | |
| Tetraethylene Glycol SCHEMBL1555416 | 0.98 | TSHR (0.58) | TSHRDAONAPRTSRD5A2CES1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103648798-B | Inner liner for pneumatic tire, its manufacture method and air-inflation tyre | KURARAY CO.,LTD. (JP) | 2016-04-20 | — | — | CN | disclosed |
| EP-1412425-B1 | BREATHABLE BIODEGRADABLE HOT MELT COMPOSITION | FULLER H B LICENSING FINANC (US) | 2006-10-18 | — | — | EP | disclosed |