Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 3/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9119829 | 0.70 | PTGS2 (0.54) | PTGS1PTGS2ALOX5 | |
| SCHEMBL9122434 | 0.60 | PTGS2 (0.54) | PTGS1PTGS2 | |
| SCHEMBL9738594 | 0.59 | PTGS1 (0.34) | PTGS1PTGS2 | |
| SCHEMBL9122974 | 0.59 | PTGS1 (0.40) | PTGS1PTGS2 | |
| SCHEMBL9431602 | 0.59 | KIF11 (0.44) | PTGS1PTGS2 | |
| SCHEMBL3618030 | 0.58 | PTGS1 (0.40) | PTGS1PTGS2 | |
| SCHEMBL9121748 | 0.57 | PTGS1 (0.33) | PTGS1PTGS2 | |
| SCHEMBL6975008 | 0.57 | PTGS1 (0.37) | PTGS1PTGS2 | |
| SCHEMBL9424431 | 0.57 | PTGS1 (0.39) | PTGS1PTGS2 | |
| SCHEMBL9120689 | 0.55 | PTGS1 (0.35) | PTGS1PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1992013844-A1 | SUBSTITUTED 4,6-DI-TERTIARY-BUTYL-5-HYDROXY-PYRIMIDINES | WARNER-LAMBERT COMPANY (US) | 1992-08-20 | — | — | WO | disclosed |