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 | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 5/20 | 0.55 |
| ▸ | RXRB | P28702 | 4/20 | 0.55 |
| ▸ | RXRG | P48443 | 3/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.45 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.44 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.44 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5080279 | 0.96 | RXRA (0.52) | RXRARXRBRXRGKMT2ALMNA | |
| SCHEMBL8875455 | 0.92 | LMNA (0.61) | RXRARXRBRXRGKMT2ALMNA | |
| SCHEMBL9364258 | 0.91 | KMT2A (0.54) | RXRARXRBRXRGKMT2ALMNA | |
| SCHEMBL11608103 | 0.91 | KMT2A (0.58) | KMT2ALMNASLC6A2SLC6A3TDP1 | |
| SCHEMBL9364253 | 0.86 | RXRA (0.52) | RXRARXRBRXRGKMT2ALMNA | |
| SCHEMBL12003778 | 0.85 | KMT2A (0.58) | KMT2ALMNASLC6A2SLC6A3TDP1 | |
| SCHEMBL8839072 | 0.84 | RARB (0.53) | RXRARXRBRXRGKMT2ALMNA | |
| SCHEMBL11607589 | 0.84 | MEN1 (0.49) | KMT2ALMNARAB9ANPC1MEN1 | |
| SCHEMBL11610430 | 0.84 | LMNA (0.50) | KMT2ALMNASLC6A2SLC6A3TDP1 | |
| Butylated Hydroxytoluene SCHEMBL16652654 | 0.83 | TDP1 (0.60) | KMT2ALMNASLC6A2SLC6A3TDP1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0465343-B1 | Pharmaceutical or cosmetical composition comprising a retinoid and a sterol in association | CIRD GALDERMA (FR) | 1994-06-15 | — | — | EP | claimed |