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 | 0.52 |
| ▸ | DAO | P14920 | 1/20 | 0.52 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.52 |
| ▸ | SRD5A2 | P31213 | 4/20 | 0.45 |
| ▸ | CES1 | P23141 | 2/20 | 0.45 |
| ▸ | CES2 | O00748 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
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 SCHEMBL5085502 | 0.86 | TSHR (0.58) | TSHRDAONAPRTSRD5A2CES1 | |
| Benzoic Acid SCHEMBL9856616 | 0.84 | TSHR (0.47) | TSHRDAONAPRTSRD5A2CES1 | |
| Benzoic Acid SCHEMBL1334580 | 0.84 | TSHR (0.47) | TSHRDAONAPRTSRD5A2CES1 | |
| Benzoic Acid SCHEMBL1782983 | 0.83 | TSHR (0.54) | TSHRDAONAPRTSRD5A2CES1 | |
| Benzoic Acid SCHEMBL5082990 | 0.82 | TSHR (0.70) | TSHRDAONAPRTSRD5A2CES1 | |
| Benzoic Acid SCHEMBL28689306 | 0.82 | DAO (0.44) | TSHRDAONAPRTSRD5A2CES1 | |
| Benzoic Acid SCHEMBL1786785 | 0.81 | DAO (0.47) | TSHRDAONAPRTSRD5A2CES1 | |
| Benzoic Acid SCHEMBL28354560 | 0.80 | DAO (0.42) | TSHRDAONAPRTSRD5A2CES1 | |
| Benzoic Acid SCHEMBL4577209 | 0.80 | TSHR (0.50) | TSHRDAONAPRTSRD5A2CES1 | |
| Benzoic Acid SCHEMBL561395 | 0.80 | TSHR (0.50) | 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-109180843-B | Non-phthalate compounds as electron donors for polyolefin catalysts | 美国台塑公司 | 2022-03-01 | — | — | CN | claimed |
| CN-109180843-B | Non-phthalate compounds as electron donors for polyolefin catalysts | 美国台塑公司 | 2022-03-01 | — | — | CN | disclosed |