Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 13/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 5/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8040638 | 0.95 | PTGS2 (0.49) | PTGS2PTGS1 | |
| SCHEMBL8053426 | 0.95 | PTGS2 (0.46) | PTGS2PTGS1 | |
| SCHEMBL215649 | 0.95 | PTGS2 (0.49) | PTGS2PTGS1 | |
| SCHEMBL8052132 | 0.95 | PTGS2 (0.48) | PTGS2PTGS1 | |
| SCHEMBL8051584 | 0.94 | PTGS2 (0.43) | PTGS2PTGS1KCNH2 | |
| SCHEMBL8051566 | 0.94 | PTGS2 (0.44) | PTGS2PTGS1KCNH2 | |
| SCHEMBL8040701 | 0.94 | PTGS2 (0.43) | PTGS2PTGS1 | |
| SCHEMBL8051595 | 0.94 | PTGS2 (0.46) | PTGS2PTGS1 | |
| SCHEMBL8040649 | 0.92 | PTGS2 (0.44) | PTGS2PTGS1KCNH2 | |
| SCHEMBL8053432 | 0.92 | PTGS2 (0.40) | PTGS2PTGS1KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0808305-B1 | 3,4-DIARYL SUBSTITUTED PYRIDINES FOR THE TREATMENT OF INFLAMMATION | SEARLE & CO (US) | 2000-05-03 | — | — | EP | disclosed |