Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 15/20 | 0.64 |
| ▸ | PTGS1 | P23219 | 13/20 | 0.64 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 1/20 | 0.48 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 3/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA4 | P22748 | 2/20 | 0.44 |
| ▸ | CA7 | P43166 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL9117510 | 0.97 | PTGS2 (0.64) | PTGS2PTGS1MAOAMAOBSOS1 | |
| SCHEMBL213440 | 0.94 | PTGS2 (0.72) | PTGS2PTGS1MAOAMAOBSOS1 | |
| SCHEMBL6913966 | 0.87 | PTGS2 (0.86) | PTGS2PTGS1 | |
| SCHEMBL9118959 | 0.86 | CA2 (0.61) | PTGS2PTGS1CA2CA12CA9 | |
| SCHEMBL9117161 | 0.86 | PTGS2 (0.49) | PTGS2PTGS1MAOAMAOBCA2 | |
| SCHEMBL9118428 | 0.86 | PTGS2 (0.52) | PTGS2PTGS1MAOAMAOBCA2 | |
| SCHEMBL9118655 | 0.85 | CA12 (0.55) | PTGS2PTGS1CA2CA12CA9 | |
| SCHEMBL9117013 | 0.85 | PTGS2 (0.56) | PTGS2PTGS1MAOAMAOBCA2 | |
| SCHEMBL9117156 | 0.85 | PTGS2 (0.46) | PTGS2PTGS1CA2CA12CA9 | |
| SCHEMBL9117753 | 0.84 | KIF11 (0.62) | PTGS2PTGS1CA2CA12CA9 |
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 |