Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 5/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 5/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | CTSL | P07711 | 1/20 | 0.32 |
| ▸ | CTSB | P07858 | 1/20 | 0.32 |
| ▸ | CTSS | P25774 | 1/20 | 0.32 |
| ▸ | IRAK4 | Q9NWZ3 | 6/20 | 0.31 |
| ▸ | ACP1 | P24666 | 1/20 | 0.31 |
| ▸ | MAP4K4 | O95819 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6588230 | 0.87 | CHEK1 (0.36) | HCRTR1HCRTR2CHEK1KCNH2CTSK | |
| SCHEMBL4765103 | 0.86 | HCRTR1 (0.34) | HCRTR1HCRTR2CHEK1KCNH2CTSK | |
| SCHEMBL5099674 | 0.77 | KMT2A (0.37) | KCNH2 | |
| SCHEMBL4766735 | 0.76 | CTSK (0.38) | CTSKCTSLCTSBCTSS | |
| SCHEMBL4765235 | 0.76 | HCRTR1 (0.34) | HCRTR1HCRTR2CHEK1KCNH2CTSK | |
| SCHEMBL6589591 | 0.75 | CTSK (0.34) | HCRTR1HCRTR2CTSKCTSLCTSB | |
| SCHEMBL5971336 | 0.74 | IRAK4 (0.33) | KCNH2IRAK4 | |
| SCHEMBL4765023 | 0.74 | CTSD (0.38) | KCNH2 | |
| SCHEMBL6605289 | 0.72 | SLC6A2 (0.34) | KCNH2CTSKCTSLCTSBCTSS | |
| SCHEMBL5098703 | 0.71 | CTSK (0.52) | HCRTR1HCRTR2CTSKCTSLCTSB |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1307204-A4 | PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORP (US) | 2004-06-02 | — | — | EP | disclosed |
| EP-1307204-A1 | PROTEASE INHIBITORS | SmithKline Beecham Corporation (US) | 2003-05-07 | — | — | EP | disclosed |
| EP-1158986-A4 | PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORP (US) | 2002-03-27 | — | — | EP | disclosed |
| WO-2001095911-A1 | PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2001-12-20 | — | — | WO | disclosed |
| EP-1158986-A1 | PROTEASE INHIBITORS | SmithKline Beecham Corporation (US) | 2001-12-05 | — | — | EP | disclosed |
| WO-2000038687-A1 | PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2000-07-06 | — | — | WO | disclosed |