Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 13/20 | 0.59 |
| ▸ | PTGS1 | P23219 | 6/20 | 0.59 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.37 |
| ▸ | CDK9 | P50750 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
| ▸ | GPR55 | Q9Y2T6 | 2/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | PIP5K1C | O60331 | 1/20 | 0.35 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.35 |
| ▸ | PI4KA | P42356 | 1/20 | 0.35 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.35 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.35 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9117222 | 0.97 | PTGS2 (0.59) | PTGS2PTGS1ALOX5APCDK9CTSK | |
| SCHEMBL9117440 | 0.95 | PTGS2 (0.66) | PTGS2PTGS1CDK9CTSKGPR55 | |
| SCHEMBL9118447 | 0.88 | PTGS2 (0.44) | PTGS2PTGS1ALOX5APCTSKPIK3CD | |
| SCHEMBL9119117 | 0.88 | PTGS2 (0.44) | PTGS2PTGS1ALOX5APCTSKPIK3CD | |
| SCHEMBL9116382 | 0.87 | PTGS2 (0.49) | PTGS2PTGS1 | |
| SCHEMBL9118491 | 0.87 | PTGS2 (0.43) | PTGS2PTGS1ALOX5APCTSKPIK3CD | |
| SCHEMBL9119889 | 0.86 | PTGS2 (0.43) | PTGS2PTGS1ALOX5APCTSKPIK3CD | |
| SCHEMBL9118009 | 0.86 | PTGS2 (0.44) | PTGS2PTGS1ALOX5APCTSKPIK3CD | |
| SCHEMBL9118885 | 0.86 | PTGS2 (0.44) | PTGS2PTGS1ALOX5APCTSKPIK3CD | |
| SCHEMBL9119679 | 0.85 | PTGS2 (0.41) | PTGS2PTGS1ALOX5APCTSKPIK3CD |
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 |
|---|---|---|---|---|---|---|---|
| WO-1995030652-A1 | SUBSTITUTED SPIRODIENES FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1995-11-16 | — | — | WO | claimed |
| WO-1995030652-A1 | SUBSTITUTED SPIRODIENES FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1995-11-16 | — | — | WO | disclosed |