Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 6/20 | 0.47 |
| ▸ | APP | P05067 | 1/20 | 0.47 |
| ▸ | MME | P08473 | 1/20 | 0.47 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | XIAP | P98170 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12495036 | 1.00 | ACE (0.47) | ACEAPPMMECASP1CASP3 | |
| SCHEMBL12493927 | 0.90 | ACE (0.47) | ACEAPPMMECASP1CASP3 | |
| SCHEMBL12495033 | 0.88 | ACE (0.45) | ACEAPPMMECASP1CASP3 | |
| SCHEMBL12494621 | 0.88 | ACE (0.45) | ACEAPPMMECASP1CASP3 | |
| SCHEMBL18659046 | 0.85 | ACE (0.47) | ACEAPPMMEXIAP | |
| SCHEMBL17770883 | 0.85 | ACE (0.41) | ACEAPPMME | |
| SCHEMBL12528544 | 0.85 | ACE (0.41) | ACEAPPMME | |
| SCHEMBL12494748 | 0.83 | ACE (0.48) | ACEAPPMMECASP1CASP3 | |
| SCHEMBL12493944 | 0.81 | ACE (0.50) | ACEAPPMMECASP1CASP3 | |
| SCHEMBL12494394 | 0.80 | ACE (0.53) | ACEAPPMMECASP1CASP3 |
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-2012125622-A1 | SUBSTITUTED ADIPIC ACID AMIDES AND USES THEREOF | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-09-20 | — | — | WO | disclosed |