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 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
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 SCHEMBL8551806 | 0.78 | MEN1 (0.31) | TMEM97SIGMAR1KMT2AMEN1 | |
| Benzoic Acid SCHEMBL8552961 | 0.77 | MEN1 (0.30) | KMT2AMEN1 | |
| Benzoic Acid SCHEMBL8548987 | 0.77 | NPC1 (0.35) | KMT2AMEN1 | |
| Benzoic Acid SCHEMBL8549411 | 0.74 | ACHE (0.37) | SIGMAR1KMT2AL3MBTL1MEN1 | |
| Benzoic Acid SCHEMBL8550961 | 0.72 | PFKFB3 (0.31) | — | |
| Benzoic Acid SCHEMBL8549809 | 0.69 | FYN (0.31) | — | |
| Benzoic Acid SCHEMBL7141730 | 0.69 | HTR1F (0.34) | KMT2AMEN1 | |
| Benzoic Acid SCHEMBL8548262 | 0.68 | — | — | |
| Benzoic Acid SCHEMBL8549272 | 0.67 | NPC1 (0.35) | KMT2AMEN1 | |
| Benzoic Acid SCHEMBL8435537 | 0.67 | PDPK1 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998015545-A1 | NEW SEROTONIN 5-HT1F AGONISTS | ELI LILLY AND COMPANY (US) | 1998-04-16 | — | — | WO | disclosed |