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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | DAO | P14920 | 1/20 | 0.56 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 3/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | PIN1 | Q13526 | 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 | |
|---|---|---|---|---|
| Benzoic Acid SCHEMBL8413078 | 1.00 | ALDH1A1 (0.56) | ALDH1A1LMNATSHRDAONAPRT | |
| Benzoic Acid SCHEMBL27621881 | 0.93 | MEN1 (0.50) | ALDH1A1LMNATSHRDAONAPRT | |
| Benzoic Acid SCHEMBL27511031 | 0.91 | NPC1 (0.49) | ALDH1A1LMNATSHRDAONAPRT | |
| Acetophenone SCHEMBL27892435 | 0.88 | ALDH1A1 (0.56) | ALDH1A1LMNATSHRHSD17B10MEN1 | |
| Benzophenone SCHEMBL8217631 | 0.88 | ELANE (0.58) | ALDH1A1LMNATSHRHSD17B10MEN1 | |
| Ethyl Benzoate SCHEMBL27407882 | 0.86 | LMNA (0.61) | ALDH1A1LMNATSHRHSD17B10MEN1 | |
| 4-Methylbenzoic Acid SCHEMBL2363 | 0.86 | ALDH1A1 (0.65) | ALDH1A1LMNATSHRHSD17B10MEN1 | |
| Benzoic Acid SCHEMBL11308878 | 0.86 | ALDH1A1 (0.62) | ALDH1A1LMNATSHRDAONAPRT | |
| Benzoic Acid SCHEMBL11315587 | 0.86 | TSHR (0.58) | ALDH1A1LMNATSHRDAONAPRT | |
| Benzoic Acid SCHEMBL28661767 | 0.85 | LMNA (0.65) | ALDH1A1LMNATSHRDAONAPRT |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112585147-B | MAP4K4 inhibitors | 帝国理工学院创新有限公司 | 2023-12-05 | — | — | CN | disclosed |
| CN-102858944-B | Delivery of particles | 宝洁公司 | 2016-08-24 | — | — | CN | disclosed |
| CN-100480697-C | Quality control method for injection containing breviscapini and dipyridamole | GUIYANG YUNYAN XICHUANG PHARM (CN) | 2009-04-22 | — | — | CN | disclosed |
| CN-101158670-A | Quality control method of pharmaceutical composition | BEIJING QI YUAN YI PHARM RES (CN) | 2008-04-09 | — | — | CN | disclosed |
| CN-1951417-A | Quality control method of a pharmaceutical composition | BEIJING QI YUAN YI PHARM RES (CN) | 2007-04-25 | — | — | CN | disclosed |
| CN-1951427-A | Quality control method of a pharmaceutical composition | BEIJING QI YUAN YI PHARM RES (CN) | 2007-04-25 | — | — | CN | disclosed |
| CN-1951426-A | Quality control method of a compound Chinese medicinal preparation | BEIJING QI YUAN YI PHARM RES (CN) | 2007-04-25 | — | — | CN | disclosed |
| CN-1951416-A | Quality control method of a compound Chinese medicinal preparation | BEIJING QI YUAN YI PHARM RES (CN) | 2007-04-25 | — | — | CN | disclosed |
| CN-1951431-A | Quality control method of a pharmaceutical composition | BEIJING QI YUAN YI PHARM RES (CN) | 2007-04-25 | — | — | CN | disclosed |
| CN-1939368-A | Quality control of Chinese medicinal compound preparation | QIYUANYIDE DRUG INST BEIJING (CN) | 2007-04-04 | — | — | CN | disclosed |
| CN-1939372-A | Quality control of medicine composition | QIYUANYIDE DRUG INST BEIJING (CN) | 2007-04-04 | — | — | CN | disclosed |
| CN-1935199-A | Quality control method for Chinese medicine compound preparation | BEIJING QIYUAN YIDE DRUG INST (CN) | 2007-03-28 | — | — | CN | disclosed |
| CN-1876022-A | Pharmaceutical composition with red sage root and Erigeron breviscapus for treating cerebrovascular disease, its preparation process and quality control method | GUIYANG YUNYAN XICHUANG PHARM (CN) | 2006-12-13 | — | — | CN | disclosed |
| CN-1808114-A | Quality control method for injection containing breviscapini and dipyridamole | GUIYANG YUNYAN XICHUANG PHARM (CN) | 2006-07-26 | — | — | CN | disclosed |
| CN-1356977-A | Glucagon antagonists/inverse agonists | NOVO NORDISK AS (DK) | 2002-07-03 | — | — | CN | disclosed |
| CN-1049423-C | Aromatic carboxylic acid derivatives | HOFFMANN LA ROCHE (CH) | 2000-02-16 | — | — | CN | disclosed |