Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 16/20 | 0.64 |
| ▸ | PTGS1 | P23219 | 12/20 | 0.64 |
| ▸ | PDPK1 | O15530 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL8764637 | 0.93 | PTGS2 (0.72) | PTGS2PTGS1PDPK1 | |
| SCHEMBL8765109 | 0.93 | PTGS2 (0.56) | PTGS2PTGS1 | |
| SCHEMBL8634736 | 0.91 | PTGS2 (0.52) | PTGS2PTGS1 | |
| Dimethylamine SCHEMBL8635160 | 0.91 | PTGS2 (0.67) | PTGS2PTGS1PDPK1 | |
| SCHEMBL8637124 | 0.91 | PTGS2 (0.64) | PTGS2PTGS1PDPK1 | |
| SCHEMBL8635155 | 0.90 | PTGS2 (0.65) | PTGS2PTGS1PDPK1 | |
| Dimethylamine SCHEMBL8765090 | 0.90 | PTGS2 (0.53) | PTGS2PTGS1 | |
| SCHEMBL214910 | 0.90 | PTGS2 (0.54) | PTGS2PTGS1 | |
| SCHEMBL8765218 | 0.90 | PTGS2 (0.54) | PTGS2PTGS1 | |
| SCHEMBL8635532 | 0.90 | PTGS2 (0.68) | PTGS2PTGS1PDPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0830133-A1 | THERAPEUTIC COMPOSITION FOR ARTHRITIS | Takeda Chemical Industries, Ltd. (JP) | 1998-03-25 | — | — | EP | disclosed |
| WO-1996033717-A1 | THERAPEUTIC COMPOSITION FOR ARTHRITIS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-10-31 | — | — | WO | disclosed |