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 | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | CCR3 | P51677 | 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 | |
|---|---|---|---|---|
| SCHEMBL6260511 | 0.87 | GBA1 (0.62) | GBA1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL6153782 | 0.85 | GBA1 (0.61) | GBA1MEN1KMT2A | |
| SCHEMBL895063 | 0.83 | GBA1 (0.66) | GBA1 | |
| Bromide SCHEMBL7246786 | 0.82 | GBA1 (0.63) | GBA1 | |
| Hydrochloric Acid SCHEMBL4247331 | 0.82 | GBA1 (0.63) | GBA1 | |
| SCHEMBL1633286 | 0.78 | GBA1 (0.60) | GBA1 | |
| SCHEMBL9400535 | 0.77 | GBA1 (0.79) | GBA1MEN1KMT2ACCR3 | |
| SCHEMBL13330901 | 0.77 | GBA1 (0.58) | GBA1 | |
| SCHEMBL20015340 | 0.77 | GBA1 (0.58) | GBA1 | |
| Bicarbonate SCHEMBL9362828 | 0.77 | EPHX2 (0.52) | MEN1KMT2APOLBCCR3 |
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 |
|---|---|---|---|---|---|---|---|
| US-5034401-A | Cardiovascular disorders or antiischemia agents | SYNTHELABO (FR) | 1991-07-23 | — | — | US | disclosed |