Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 8/20 | 0.55 |
| ▸ | CTSL | P07711 | 6/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | REN | P00797 | 11/20 | 0.46 |
| ▸ | CTSK | P43235 | 3/20 | 0.46 |
| ▸ | CTSB | P07858 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3602438 | 1.00 | CTSS (0.55) | CTSSCTSLPKMSMN1; SMN2REN | |
| SCHEMBL5508515 | 0.90 | REN (0.47) | CTSSPKMSMN1; SMN2REN | |
| SCHEMBL5509283 | 0.90 | REN (0.47) | CTSSPKMSMN1; SMN2REN | |
| SCHEMBL1865703 | 0.89 | REN (0.52) | REN | |
| SCHEMBL5503829 | 0.89 | REN (0.52) | REN | |
| SCHEMBL1866281 | 0.89 | REN (0.52) | REN | |
| SCHEMBL5509831 | 0.89 | REN (0.52) | REN | |
| SCHEMBL5505794 | 0.89 | REN (0.52) | REN | |
| SCHEMBL5509317 | 0.89 | PKM (0.44) | CTSSCTSLPKMSMN1; SMN2REN | |
| SCHEMBL1867207 | 0.84 | CTSS (0.54) | CTSSCTSLPKMSMN1; SMN2REN |
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-8455521-B2 | Diaminoalkane aspartic protease inhibitors | VITAE PHARMACEUTICALS, INC. (US) | 2013-06-04 | — | — | US | disclosed |