Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.39 |
| ▸ | F10 | P00742 | 4/20 | 0.38 |
| ▸ | PTGES2 | Q9H7Z7 | 3/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.37 |
| ▸ | CCR6 | P51684 | 1/20 | 0.36 |
| ▸ | KLK1 | P06870 | 1/20 | 0.36 |
| ▸ | ALOX5AP | P20292 | 3/20 | 0.36 |
| ▸ | FEN1 | P39748 | 3/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | CA5A | P35218 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.35 |
| ▸ | P2RY1 | P47900 | 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 | |
|---|---|---|---|---|
| SCHEMBL8974585 | 0.82 | KIF11 (0.46) | KIF11CCR6CA1CA2CA9 | |
| SCHEMBL8973879 | 0.78 | KIF11 (0.45) | KIF11CA1CA2CA9 | |
| SCHEMBL8974421 | 0.78 | PTGS2 (0.43) | KIF11 | |
| SCHEMBL9117008 | 0.78 | HSD11B1 (0.41) | KIF11PTGES2NPC1RAB9A | |
| SCHEMBL6883474 | 0.78 | KIF11 (0.50) | KIF11PTGES2HCRTR1HCRTR2ALOX5AP | |
| SCHEMBL8974117 | 0.74 | PTGS2 (0.40) | — | |
| SCHEMBL8973763 | 0.70 | POLB (0.41) | KIF11CA1CA2CA9 | |
| SCHEMBL8973781 | 0.69 | KIF11 (0.59) | KIF11CA1CA2CA9 | |
| SCHEMBL8974757 | 0.68 | CA2 (0.41) | CA1CA2CA5ACA9 | |
| SCHEMBL8974407 | 0.68 | PTGS2 (0.41) | CA1CA2CA5ACA9 |
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-1995030656-A1 | SUBSTITUTED CYCLOPENTADIENYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1995-11-16 | — | — | WO | disclosed |