Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 5/20 | 0.55 |
| ▸ | AKR1C3 | P42330 | 13/20 | 0.54 |
| ▸ | AKR1C2 | P52895 | 13/20 | 0.54 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.54 |
| ▸ | CDC42 | P60953 | 1/20 | 0.54 |
| ▸ | RAC1 | P63000 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.54 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11476903 | 0.95 | PTGS2 (0.58) | PTGS2AKR1C3AKR1C2PTGS1CDC42 | |
| SCHEMBL11742200 | 0.94 | PTGS2 (0.57) | PTGS2AKR1C3AKR1C2PTGS1CDC42 | |
| SCHEMBL11470486 | 0.86 | AKR1C3 (0.69) | PTGS2AKR1C3AKR1C2PTGS1CDC42 | |
| Ammonia Solution, Strong SCHEMBL11721423 | 0.84 | AKR1C3 (0.67) | PTGS2AKR1C3AKR1C2PTGS1CDC42 | |
| SCHEMBL30882142 | 0.82 | PTGS2 (0.43) | PTGS2AKR1C3AKR1C2PTGS1CDC42 | |
| SCHEMBL29226110 | 0.82 | PTGS2 (0.43) | PTGS2AKR1C3AKR1C2PTGS1CDC42 | |
| SCHEMBL11471204 | 0.81 | AKR1C3 (0.59) | PTGS2AKR1C3AKR1C2PTGS1CDC42 | |
| SCHEMBL18770095 | 0.79 | TDP1 (0.50) | PTGS2AKR1C3AKR1C2PTGS1CDC42 | |
| SCHEMBL11462290 | 0.79 | TDP1 (0.50) | PTGS2AKR1C3AKR1C2PTGS1CDC42 | |
| SCHEMBL6775188 | 0.79 | PTGS2 (0.64) | PTGS2AKR1C3AKR1C2PTGS1CDC42 |
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-4001301-A | ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIPYRETICS, ANTI-PRURITIC | SYNTEX CORPORATION (PM) | 1977-01-04 | — | — | US | disclosed |