Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 13/20 | 0.52 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.47 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | KIF11 | P52732 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 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 | |
|---|---|---|---|---|
| SCHEMBL8974423 | 0.87 | PTGS2 (0.54) | PTGS2PTGDR2AKR1C3KIF11 | |
| SCHEMBL8974074 | 0.87 | PTGS2 (0.54) | PTGS2PTGDR2KIF11 | |
| SCHEMBL8974329 | 0.87 | PTGS2 (0.47) | PTGS2PTGDR2KIF11PTGS1 | |
| SCHEMBL8974636 | 0.87 | PTGS2 (0.42) | PTGS2PTGDR2PTGS1 | |
| SCHEMBL8974579 | 0.86 | KIF11 (0.62) | PTGS2KIF11PTGS1 | |
| SCHEMBL8974314 | 0.84 | PTGS2 (0.55) | PTGS2PTGS1 | |
| SCHEMBL8974307 | 0.82 | PTGS2 (0.57) | PTGS2AKR1C3KIF11PTGS1 | |
| SCHEMBL8973791 | 0.82 | PTGS2 (0.57) | PTGS2AKR1C3KIF11PTGS1 | |
| SCHEMBL8974223 | 0.82 | POLB (0.37) | PTGS2PTGDR2KIF11PTGS1 | |
| SCHEMBL6324533 | 0.81 | PTGS2 (0.56) | PTGS2AKR1C3KIF11PTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5576339-A | Pyridyl substituted cyclopentadienes for the treatment of inflamation | HUANG HORNG-CHIH (US) | 1996-11-19 | — | — | US | disclosed |
| US-5418254-A | Side effect reduction | G. D. SEARLE & CO. (US) | 1995-05-23 | — | — | US | disclosed |