Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.35 |
| ▸ | PGR | P06401 | 2/20 | 0.35 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL25952453 | 0.90 | PTGS1 (0.49) | PTGS1PTGS2NR3C1PGRNR3C2 | |
| SCHEMBL19810406 | 0.81 | PTGS1 (0.42) | PTGS1PTGS2NR3C1PGRNR3C2 | |
| SCHEMBL13534195 | 0.77 | NOTUM (0.38) | NOTUM | |
| SCHEMBL23505785 | 0.77 | NOTUM (0.49) | NOTUM | |
| SCHEMBL13551187 | 0.76 | NOTUM (0.33) | NR3C1PGRNR3C2NOTUM | |
| SCHEMBL7136286 | 0.75 | PTGS2 (0.52) | PTGS1PTGS2 | |
| SCHEMBL24252953 | 0.74 | NOTUM (0.38) | NOTUM | |
| SCHEMBL14411960 | 0.74 | NOTUM (0.38) | NOTUM | |
| SCHEMBL30451991 | 0.74 | NOTUM (0.38) | NOTUM | |
| SCHEMBL23350956 | 0.74 | MAP3K14 (0.31) | PTGS1PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7964624-B1 | Inhibitors of serine proteases | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2011-06-21 | — | — | US | disclosed |