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 | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 2/20 | 0.53 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.53 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.49 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.49 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | DAO | P14920 | 1/20 | 0.48 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.47 |
| ▸ | PLA2G4B | P0C869 | 3/20 | 0.46 |
| ▸ | RXRA | P19793 | 2/20 | 0.46 |
| ▸ | RXRB | P28702 | 1/20 | 0.46 |
| ▸ | RXRG | P48443 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL1749934 | 0.89 | ALDH1A1 (0.57) | NR4A2TSHRALDH1A1SMN1; SMN2PLA2G4B | |
| Benzoic Acid SCHEMBL28538095 | 0.87 | LMNA (0.60) | LMNAKMT2ASRD5A2TSHRDAO | |
| SCHEMBL3312463 | 0.87 | MRGPRX4 (0.60) | KMT2AALDH1A1SMN1; SMN2MRGPRX4PLA2G4B | |
| Benzoic Acid SCHEMBL6129434 | 0.85 | LMNA (0.58) | LMNAKMT2ASRD5A2TSHRDAO | |
| Benzoic Acid SCHEMBL2321548 | 0.85 | LMNA (0.58) | LMNAKMT2ASRD5A2TSHRDAO | |
| SCHEMBL145534 | 0.85 | TSHR (0.64) | TDP1TSHRALDH1A1 | |
| Fluoride SCHEMBL27629172 | 0.83 | TSHR (0.61) | TDP1TSHRALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL7584113 | 0.83 | TSHR (0.61) | TDP1TSHRALDH1A1 | |
| Bromide SCHEMBL31356883 | 0.83 | TSHR (0.61) | TDP1TSHRALDH1A1 | |
| SCHEMBL18722904 | 0.81 | TSHR (0.58) | LMNATDP1TSHRALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7498372-B2 | Phthalate-free; such as 3-benzyloxy-1,2-propyl dibenzoate; for use with vinyl polymers, rubbers, polyurethanes, and acrylics | FERRO CORPORATION (US) | 2009-03-03 | — | — | US | claimed |
| US-20070123622-A1 | ETHER-ESTER PLASTICIZERS | FERRO CORPORATION (US) | 2007-05-31 | — | — | US | claimed |
| US-7498372-B2 | Phthalate-free; such as 3-benzyloxy-1,2-propyl dibenzoate; for use with vinyl polymers, rubbers, polyurethanes, and acrylics | FERRO CORPORATION (US) | 2009-03-03 | — | — | US | disclosed |
| US-20070123622-A1 | ETHER-ESTER PLASTICIZERS | FERRO CORPORATION (US) | 2007-05-31 | — | — | US | disclosed |