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 | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.63 |
| ▸ | LMNA | P02545 | 2/20 | 0.59 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | DAO | P14920 | 1/20 | 0.52 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.52 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | ESR1 | P03372 | 1/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.47 |
| ▸ | F2 | P00734 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL1449565 | 0.94 | TDP1 (0.70) | TDP1LMNATSHRMAPK1HIF1A | |
| Hydrochloric Acid SCHEMBL9114435 | 0.92 | TDP1 (0.68) | TDP1LMNATSHRMAPK1HIF1A | |
| SCHEMBL30823716 | 0.92 | TDP1 (0.68) | TDP1LMNATSHRMAPK1HIF1A | |
| SCHEMBL11854031 | 0.92 | TDP1 (0.52) | TDP1LMNATSHRMAPK1SLC6A2 | |
| Benzoic Acid SCHEMBL29182063 | 0.88 | TDP1 (0.73) | TDP1LMNATSHRDAONAPRT | |
| SCHEMBL11352210 | 0.87 | TDP1 (0.61) | TDP1LMNATSHRMAPK1HIF1A | |
| SCHEMBL27853082 | 0.86 | TDP1 (0.70) | TDP1LMNATSHRDAONAPRT | |
| Trifluoroacetic Acid SCHEMBL28490953 | 0.84 | TDP1 (0.58) | TDP1LMNATSHRMAPK1HIF1A | |
| Benzoic Acid SCHEMBL10952729 | 0.84 | TSHR (0.74) | TDP1TSHRDAONAPRTMAPK1 | |
| Benzoic Acid SCHEMBL11767340 | 0.84 | TSHR (0.74) | TDP1TSHRDAONAPRTMAPK1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115969862-A | Application of 2-aminoethyl dibenzoborate in preparation of medicines for treating leucocythemia | 深圳市第二人民医院(深圳市转化医学研究院) | 2023-04-18 | — | — | CN | claimed |
| CN-115969862-A | Application of 2-aminoethyl dibenzoborate in preparation of medicines for treating leucocythemia | 深圳市第二人民医院(深圳市转化医学研究院) | 2023-04-18 | — | — | CN | disclosed |
| CN-115969862-A | Application of 2-aminoethyl dibenzoborate in preparation of medicines for treating leucocythemia | 深圳市第二人民医院(深圳市转化医学研究院) | 2023-04-18 | — | — | CN | disclosed |
| CN-113906945-A | Method for promoting accumulation of flavonoid content in camellia oleifera seeds | 中南林业科技大学 | 2022-01-11 | — | — | CN | disclosed |
| CN-113826502-A | Method for increasing flavonoid content in camellia oleifera seeds | 中南林业科技大学 | 2021-12-24 | — | — | CN | disclosed |