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 | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.43 |
| ▸ | F2 | P00734 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | DAO | P14920 | 1/20 | 0.42 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 2/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL130435 | 0.95 | LMNA (0.64) | LMNATDP1TSHRMAPK1SLC6A2 | |
| SCHEMBL1771682 | 0.95 | LMNA (0.64) | LMNATDP1TSHRMAPK1SLC6A2 | |
| SCHEMBL130434 | 0.95 | LMNA (0.64) | LMNATDP1TSHRMAPK1SLC6A2 | |
| (Z)-Hex-3-En-1-Yl Acetate SCHEMBL28969715 | 0.90 | LMNA (0.57) | LMNATDP1TSHRMAPK1SLC6A2 | |
| SCHEMBL30285512 | 0.86 | LMNA (0.69) | LMNATDP1MAPTTSHRMAPK1 | |
| SCHEMBL3751588 | 0.85 | TDP1 (0.67) | LMNATDP1MAPTTSHRMAPK1 | |
| SCHEMBL3751591 | 0.85 | TDP1 (0.67) | LMNATDP1MAPTTSHRMAPK1 | |
| SCHEMBL30853560 | 0.84 | LMNA (0.48) | LMNATDP1TSHRMAPK1KMT2A | |
| SCHEMBL1883430 | 0.84 | LMNA (0.48) | LMNATDP1TSHRMAPK1KMT2A | |
| SCHEMBL27491796 | 0.84 | TDP1 (0.65) | LMNATDP1MAPTTSHRMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2496682-A1 | DELIVERY PARTICLE | The Procter & Gamble Company (US) | 2012-09-12 | — | — | EP | disclosed |
| WO-2011056935-A1 | DELIVERY PARTICLE | THE PROCTER & GAMBLE COMPANY (US) | 2011-05-12 | — | — | WO | disclosed |