Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 13/20 | 0.57 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.50 |
| ▸ | KIF11 | P52732 | 3/20 | 0.47 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8974455 | 0.88 | PTGS2 (0.55) | PTGS2PTGS1KIF11AKR1C3 | |
| SCHEMBL8974645 | 0.88 | PTGS2 (0.57) | PTGS2PTGS1KIF11AKR1C3 | |
| SCHEMBL8974655 | 0.86 | PTGS2 (0.56) | PTGS2PTGS1KIF11AKR1C3 | |
| SCHEMBL8974123 | 0.86 | KIF11 (0.68) | PTGS2PTGS1KIF11 | |
| SCHEMBL9116083 | 0.86 | PTGS2 (0.44) | PTGS2PTGS1KIF11 | |
| SCHEMBL8974551 | 0.86 | PTGS2 (0.46) | PTGS2PTGS1KIF11 | |
| SCHEMBL9117648 | 0.85 | PTGS2 (0.71) | PTGS2PTGS1KIF11AKR1C3 | |
| SCHEMBL8974331 | 0.84 | PTGS2 (0.54) | PTGS2PTGS1KIF11 | |
| SCHEMBL9117490 | 0.84 | PTGS2 (0.54) | PTGS2PTGS1KIF11 | |
| SCHEMBL7506839 | 0.83 | PTGS2 (0.72) | PTGS2KIF11AKR1C3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1995030656-A1 | SUBSTITUTED CYCLOPENTADIENYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1995-11-16 | — | — | WO | claimed |
| US-5576339-A | Pyridyl substituted cyclopentadienes for the treatment of inflamation | HUANG HORNG-CHIH (US) | 1996-11-19 | — | — | US | disclosed |
| WO-1995030656-A1 | SUBSTITUTED CYCLOPENTADIENYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1995-11-16 | — | — | WO | disclosed |
| US-5418254-A | Side effect reduction | G. D. SEARLE & CO. (US) | 1995-05-23 | — | — | US | disclosed |