Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 6/20 | 0.47 |
| ▸ | TOP2A | P11388 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | P2RX3 | P56373 | 3/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | KIT | P10721 | 1/20 | 0.41 |
| ▸ | F10 | P00742 | 3/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.40 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8662796 | 0.91 | POLB (0.41) | PTGS2TOP2APTGS1BRD4P2RX3 | |
| SCHEMBL8659929 | 0.90 | PTGS2 (0.58) | PTGS2PTGS1BRD4P2RX3MAPT | |
| SCHEMBL8656219 | 0.90 | PTGS2 (0.46) | PTGS2PTGS1F10 | |
| SCHEMBL8661650 | 0.90 | PTGS2 (0.46) | PTGS2PTGS1BRD4P2RX3MAPT | |
| SCHEMBL8656787 | 0.88 | PTGS2 (0.39) | PTGS2TOP2APTGS1P2RX3USP2 | |
| SCHEMBL8657255 | 0.88 | CA9 (0.44) | PTGS2PTGS1BRD4MAPTF10 | |
| SCHEMBL8661261 | 0.87 | PTGS1 (0.40) | PTGS2PTGS1P2RX3ALDH1A1HSP90AA1 | |
| SCHEMBL8660155 | 0.87 | PTGS2 (0.40) | PTGS2PTGS1P2RX3ALDH1A1HSP90AA1 | |
| SCHEMBL8658302 | 0.87 | PTGS2 (0.39) | PTGS2PTGS1BRD4P2RX3F10 | |
| SCHEMBL8661927 | 0.84 | PTGS2 (0.36) | PTGS2PTGS1P2RX3ALDH1A1HSP90AA1 |
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-5739166-A | ALKYLSULFONYL OR AMINOSULFONYL SUBSTITUTED AROMATIC COMPOUNDS AS NON-STEROIDAL ANTIINFLAMMATORY AGENT | G.D. SEARLE & CO. (US) | 1998-04-14 | — | — | US | disclosed |