Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Aspirin. 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 | |
|---|---|---|---|---|
| ▸ | PTGS1 known ✓ | P23219 | 2/20 | 0.60 |
| ▸ | PTGS2 known ✓ | P35354 | 2/20 | 0.60 |
| ▸ | HPGD | P15428 | 7/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.60 |
| ▸ | NAPRT | Q6XQN6 | 2/20 | 0.60 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.60 |
| ▸ | ESR1 | P03372 | 1/20 | 0.60 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.60 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.60 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | GGT1 | P19440 | 1/20 | 0.60 |
| ▸ | BLM | P54132 | 1/20 | 0.60 |
| ▸ | LMNA | P02545 | 3/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Aspirin SCHEMBL11225798 | 0.84 | KDM4E (0.67) | HPGDKDM4EHSD17B10ALDH1A1PTGS1 | |
| Aspirin SCHEMBL6906125 | 0.83 | KDM4E (0.73) | HPGDKDM4EHSD17B10ALDH1A1PTGS1 | |
| Aspirin SCHEMBL11231900 | 0.82 | HSD17B10 (0.60) | HPGDKDM4EHSD17B10ALDH1A1PTGS1 | |
| Aspirin SCHEMBL11405469 | 0.82 | KDM4E (0.83) | HPGDKDM4EHSD17B10ALDH1A1PTGS1 | |
| Aspirin SCHEMBL11224513 | 0.82 | KDM4E (0.56) | HPGDKDM4EHSD17B10ALDH1A1PTGS1 | |
| SCHEMBL24260208 | 0.81 | HSD17B10 (0.48) | HPGDKDM4EHSD17B10ALDH1A1PTGS1 | |
| Acetic Acid SCHEMBL28223455 | 0.81 | HPGD (0.61) | HPGDHSD17B10ALDH1A1ITGB3MAPK1 | |
| SCHEMBL11307087 | 0.80 | KDM4E (0.55) | HPGDKDM4EHSD17B10ALDH1A1PTGS1 | |
| Aspirin SCHEMBL11226914 | 0.80 | HSD17B10 (0.56) | HPGDKDM4EHSD17B10ALDH1A1PTGS1 | |
| Aspirin SCHEMBL28369973 | 0.79 | KDM4E (0.89) | HPGDKDM4EHSD17B10ALDH1A1PTGS1 |
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-4324801-A | ANTIPYRETICS, ANALGESICS, ANTIINFLAMMATORY AGENTS, ANTICOAGULANTS, INHIBITORS OF PROSTAGLANDIN FORMATION | BANYU PHARMACEUTICAL CO. LTD. (JP) | 1982-04-13 | — | — | US | claimed |
| JP-55059138-A | — | — | None | — | — | JP | disclosed |
| US-4324801-A | ANTIPYRETICS, ANALGESICS, ANTIINFLAMMATORY AGENTS, ANTICOAGULANTS, INHIBITORS OF PROSTAGLANDIN FORMATION | BANYU PHARMACEUTICAL CO. LTD. (JP) | 1982-04-13 | — | — | US | disclosed |
| JP-S5559138-A | WATER-SOLUBLE ACETYLSALICILIC ACID, ITS PRODUCTION AND PREPARATION CONTAINING THE SAME | BANYU PHARMACEUT CO LTD | 1980-05-02 | — | — | JP | disclosed |