Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 17/20 | 0.57 |
| ▸ | CTSS | P25774 | 15/20 | 0.57 |
| ▸ | CTSL | P07711 | 15/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL5983254 | 0.88 | CTSK (0.58) | CTSKCTSSCTSLALDH1A1CTSB | |
| SCHEMBL5983535 | 0.88 | CTSK (0.58) | CTSKCTSSCTSLALDH1A1CTSB | |
| SCHEMBL8337213 | 0.87 | CTSS (0.49) | CTSKCTSSCTSLALDH1A1CTSB | |
| SCHEMBL5983028 | 0.80 | ALDH1A1 (0.46) | CTSKCTSSCTSLALDH1A1 | |
| SCHEMBL5983394 | 0.79 | CTSK (0.43) | CTSKCTSSCTSLALDH1A1CTSB | |
| SCHEMBL6072824 | 0.79 | CTSK (0.77) | CTSKCTSSCTSLCTSB | |
| SCHEMBL8337747 | 0.79 | CTSK (0.77) | CTSKCTSSCTSLCTSB | |
| SCHEMBL13784227 | 0.77 | CTSK (0.67) | CTSKCTSSCTSLALDH1A1 | |
| SCHEMBL8350567 | 0.74 | CTSS (0.57) | CTSKCTSSCTSLALDH1A1 | |
| SCHEMBL6764484 | 0.74 | CTSK (0.67) | CTSKCTSSCTSLCTSB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2006505526-A | — | — | 2006-02-16 | — | — | JP | claimed |
| EP-1539178-A2 | PROTEASE INHIBITORS | SmithKline Beecham Corporation (US) | 2005-06-15 | — | — | EP | claimed |
| WO-2004017911-A2 | PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2004-03-04 | — | — | WO | claimed |