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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.58 |
| ▸ | EZH2 | Q15910 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | DAO | P14920 | 1/20 | 0.48 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | CCR2 | P41597 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.42 |
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 SCHEMBL28378807 | 0.86 | GAA (0.58) | GAAEZH2TSHRDAONAPRT | |
| SCHEMBL10679973 | 0.86 | GAA (0.45) | GAAEZH2ALOX15POLBKMT2A | |
| 4-Chloro-Benzoic Acid SCHEMBL9813857 | 0.85 | ALOX15 (0.53) | GAAEZH2TSHRALOX15KMT2A | |
| P-Anisic Acid SCHEMBL9813609 | 0.83 | CA1 (0.59) | GAAEZH2POLBKDM4EL3MBTL1 | |
| SCHEMBL9813651 | 0.83 | SRD5A2 (0.54) | GAAEZH2KMT2ASRD5A2 | |
| Salicylic Acid SCHEMBL9813624 | 0.81 | ALDH1A1 (0.55) | GAAEZH2TSHRNAPRTALOX15 | |
| SCHEMBL10681714 | 0.80 | ALOX15 (0.45) | GAAEZH2ALOX15POLBKMT2A | |
| SCHEMBL9813697 | 0.80 | ALOX15 (0.45) | GAAEZH2ALOX15POLBKMT2A | |
| Benzoic Acid SCHEMBL23581094 | 0.79 | TSHR (0.52) | GAAEZH2TSHRDAONAPRT | |
| Pyromellitic Acid SCHEMBL10684063 | 0.79 | ALOX15 (0.46) | GAAEZH2ALOX15POLBHTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0163245-B1 | DERIVATIVES OF ALKYL-SUBSTITUTED 4-HYDROXY-METHYL-PIPERIDINE AND USE THEREOF AS STABILIZERS | AUSIMONT S.r.l. (IT) | 1991-07-31 | — | — | EP | disclosed |
| US-4772708-A | STABILIZERS FOR POLYMERS | AUSIMONT S.P.A. (IT) | 1988-09-20 | — | — | US | disclosed |
| EP-0163245-A2 | Derivatives of alkyl-substituted 4-hydroxy-methyl-piperidine and use thereof as stabilizers | AUSIMONT S.r.l. (IT) | 1985-12-04 | — | — | EP | disclosed |