Known targets — ChEMBL curated mechanism
GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHMGCRMMP1MMP13MMP7MMP8PTGS1PTGS2ileSpolrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of 4-Methylbenzoic 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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.59 |
| ▸ | CES2 | O00748 | 2/20 | 0.59 |
| ▸ | CES1 | P23141 | 2/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | CA1 | P00915 | 10/20 | 0.54 |
| ▸ | CA2 | P00918 | 10/20 | 0.54 |
| ▸ | USP2 | O75604 | 1/20 | 0.53 |
| ▸ | PKM | P14618 | 2/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | ATM | Q13315 | 2/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| 4-Methylbenzoic Acid SCHEMBL6914164 | 0.95 | CA1 (0.61) | ALDH1A1LMNACES2CES1SMN1; SMN2 | |
| 4-Methylbenzoic Acid SCHEMBL1042424 | 0.95 | CA2 (0.61) | ALDH1A1LMNACES2CES1SMN1; SMN2 | |
| 4-Methylbenzoic Acid SCHEMBL6914461 | 0.95 | ALDH1A1 (0.59) | ALDH1A1LMNACES2CES1SMN1; SMN2 | |
| 4-Methylbenzoic Acid SCHEMBL6916670 | 0.95 | ALDH1A1 (0.59) | ALDH1A1LMNACES2CES1SMN1; SMN2 | |
| 4-Methylbenzoic Acid SCHEMBL3174416 | 0.95 | ALDH1A1 (0.59) | ALDH1A1LMNACES2CES1SMN1; SMN2 | |
| 4-Methylbenzoic Acid SCHEMBL6914890 | 0.95 | ALDH1A1 (0.59) | ALDH1A1LMNACES2CES1SMN1; SMN2 | |
| 4-Methylbenzoic Acid SCHEMBL2784875 | 0.95 | ALDH1A1 (0.59) | ALDH1A1LMNACES2CES1SMN1; SMN2 | |
| 4-Methylbenzoic Acid SCHEMBL6915079 | 0.95 | ALDH1A1 (0.59) | ALDH1A1LMNACES2CES1SMN1; SMN2 | |
| 4-Methylbenzoic Acid SCHEMBL9620426 | 0.95 | ALDH1A1 (0.59) | ALDH1A1LMNACES2CES1SMN1; SMN2 | |
| 4-Methylbenzoic Acid SCHEMBL8463954 | 0.95 | ALDH1A1 (0.59) | ALDH1A1LMNACES2CES1SMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109694766-B | Lubricating grease composition and preparation method thereof | 中国石油化工股份有限公司 | 2022-06-28 | — | — | CN | disclosed |
| CN-109694771-B | Lubricating grease composition and preparation method thereof | 中国石油化工股份有限公司 | 2021-10-08 | — | — | CN | disclosed |
| US-20170332666-A1 | APPLICATION OF P-METHYL BENZOIC ACID OR SALTS THEREOF AS ADDITIVES FOR ANIMAL FEED | Guangzhou Insighter Biotechnology Co., Ltd. (CN) | 2017-11-23 | — | — | US | disclosed |