Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADAM17 | P78536 | 2/20 | 0.34 |
| ▸ | BACE1 | P56817 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13685396 | 0.92 | ADAM17 (0.37) | ADAM17BACE1 | |
| SCHEMBL13685135 | 0.91 | BACE1 (0.35) | BACE1 | |
| SCHEMBL8289459 | 0.88 | ADAM17 (0.35) | ADAM17BACE1 | |
| SCHEMBL8290694 | 0.87 | CTSD (0.38) | BACE1 | |
| SCHEMBL12607874 | 0.86 | ADAM17 (0.37) | ADAM17 | |
| SCHEMBL13685390 | 0.84 | ADAM17 (0.34) | ADAM17BACE1 | |
| SCHEMBL8291384 | 0.83 | BACE1 (0.30) | BACE1 | |
| SCHEMBL8050873 | 0.82 | BACE1 (0.38) | BACE1 | |
| SCHEMBL8291324 | 0.82 | BACE1 (0.38) | BACE1 | |
| SCHEMBL13685662 | 0.82 | BACE1 (0.30) | BACE1 |
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-7592419-B2 | Macrocyclic inhibitors of hepatitis C virus NS3-serine protease | SCHERING CORPORATION (US) | 2009-09-22 | — | — | US | disclosed |