Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GHSR | Q92847 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.36 |
| ▸ | GCK | P35557 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 4/20 | 0.32 |
| ▸ | CA4 | P22748 | 2/20 | 0.32 |
| ▸ | HPGDS | O60760 | 2/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 2/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA3 | P07451 | 1/20 | 0.31 |
| ▸ | CA6 | P23280 | 1/20 | 0.31 |
| ▸ | CA5A | P35218 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9117292 | 0.96 | GHSR (0.37) | GHSRPTGS2GCKCA2CA4 | |
| SCHEMBL9118390 | 0.90 | PTGS2 (0.39) | GHSRPTGS2GCKHPGDSKCNH2 | |
| SCHEMBL9115540 | 0.86 | GHSR (0.37) | GHSRPTGS2GCKPTGS1 | |
| SCHEMBL9243102 | 0.86 | GHSR (0.37) | GHSRPTGS2GCKPTGS1 | |
| SCHEMBL9119234 | 0.82 | PTGS2 (0.45) | GHSRPTGS2CA2CA9CA12 | |
| SCHEMBL9117725 | 0.80 | PTGS2 (0.45) | PTGS2CA2CA4CA9CA12 | |
| SCHEMBL9117271 | 0.78 | PTGS2 (0.40) | GHSRPTGS2CA2HDAC1CA9 | |
| SCHEMBL9117759 | 0.78 | PTGS2 (0.40) | GHSRPTGS2CA2HDAC1CA9 | |
| SCHEMBL8387842 | 0.78 | PTGS2 (0.41) | GHSRPTGS2GCKCA2CA4 | |
| SCHEMBL8388576 | 0.76 | PTGS2 (0.43) | GHSRPTGS2GCKPTGS1 |
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-1995030652-A1 | SUBSTITUTED SPIRODIENES FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1995-11-16 | — | — | WO | disclosed |