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 | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.58 |
| ▸ | DAO | P14920 | 1/20 | 0.58 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.58 |
| ▸ | SRD5A2 | P31213 | 3/20 | 0.50 |
| ▸ | CES1 | P23141 | 3/20 | 0.50 |
| ▸ | CES2 | O00748 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | PGR | P06401 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HRH1 | P35367 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | XBP1 | P17861 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| Benzoic Acid SCHEMBL4188267 | 0.98 | TSHR (0.61) | TSHRDAONAPRTSRD5A2CES1 | |
| Benzoic Acid SCHEMBL1255194 | 0.98 | TSHR (0.61) | TSHRDAONAPRTSRD5A2CES1 | |
| Benzoic Acid SCHEMBL4326067 | 0.98 | TSHR (0.61) | TSHRDAONAPRTSRD5A2CES1 | |
| Benzoic Acid SCHEMBL14691492 | 0.98 | TSHR (0.61) | TSHRDAONAPRTSRD5A2CES1 | |
| Benzoic Acid SCHEMBL227396 | 0.98 | TSHR (0.61) | TSHRDAONAPRTSRD5A2CES1 | |
| Benzoic Acid SCHEMBL524377 | 0.98 | TSHR (0.61) | TSHRDAONAPRTSRD5A2CES1 | |
| Benzoic Acid SCHEMBL15577101 | 0.94 | TSHR (0.56) | TSHRDAONAPRTSRD5A2CES1 | |
| Benzoic Acid SCHEMBL18813683 | 0.94 | TSHR (0.56) | TSHRDAONAPRTSRD5A2CES1 | |
| Benzoic Acid SCHEMBL28770491 | 0.92 | TSHR (0.54) | TSHRDAONAPRTSRD5A2CES1 | |
| Terephthalic Acid SCHEMBL855281 | 0.89 | TSHR (0.57) | TSHRDAONAPRTSRD5A2CES1 |
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-4432982-A | HALOGEN- APOVINCAMINOL AND TRIMETHOXYBENZOATE SALTS | RICHTER GEDEON VEGYESZETI GYAR RT. (HU) | 1984-02-21 | — | — | US | disclosed |