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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | DAO | P14920 | 1/20 | 0.50 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 3/20 | 0.44 |
| ▸ | CES1 | P23141 | 3/20 | 0.44 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL29265486 | 0.86 | ALDH1A1 (0.53) | ALDH1A1MAPTTSHRMEN1KMT2A | |
| Benzoyl Chloride SCHEMBL28932613 | 0.86 | ALDH1A1 (0.53) | ALDH1A1MAPTTSHRMEN1KMT2A | |
| Biphenyl SCHEMBL29145677 | 0.85 | ALDH1A1 (0.50) | ALDH1A1MAPTTSHRMEN1KMT2A | |
| Benzene SCHEMBL28028638 | 0.84 | ALDH1A1 (0.46) | ALDH1A1MAPTTSHRMEN1KMT2A | |
| Phenol SCHEMBL29082253 | 0.84 | ALDH1A1 (0.49) | ALDH1A1MAPTTSHRMEN1KMT2A | |
| SCHEMBL10672084 | 0.82 | ALDH1A1 (0.47) | ALDH1A1MAPTTSHRMEN1KMT2A | |
| SCHEMBL10669246 | 0.82 | ALDH1A1 (0.47) | ALDH1A1MAPTTSHRMEN1KMT2A | |
| SCHEMBL19626050 | 0.81 | MAPT (0.69) | ALDH1A1MAPTTSHRMEN1KMT2A | |
| Benzoic Acid SCHEMBL11308878 | 0.81 | ALDH1A1 (0.62) | ALDH1A1MAPTTSHRDAONAPRT | |
| SCHEMBL210277 | 0.80 | — | — |
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-115594793-A | Liquid crystal polymer and preparation method thereof | 宁夏清研高分子新材料有限公司（CN） | 2023-01-13 | — | — | CN | claimed |
| CN-115594793-B | Liquid crystal polymer and preparation method thereof | 宁夏清研高分子新材料有限公司 | 2024-06-25 | — | — | CN | disclosed |
| CN-115594793-A | Liquid crystal polymer and preparation method thereof | 宁夏清研高分子新材料有限公司（CN） | 2023-01-13 | — | — | CN | disclosed |