Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 8/20 | 0.37 |
| ▸ | CTSL | P07711 | 6/20 | 0.37 |
| ▸ | CTSS | P25774 | 6/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | USP30 | Q70CQ3 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | CTSB | P07858 | 1/20 | 0.32 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.32 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6072630 | 0.92 | CTSK (0.39) | KDM4EGAACTSKCTSLCTSS | |
| SCHEMBL6072667 | 0.83 | CTSK (0.41) | CTSKCTSLCTSSUSP30CTSB | |
| SCHEMBL6073049 | 0.83 | CTSK (0.39) | CTSKCTSLCTSSUSP30CTSB | |
| SCHEMBL7007037 | 0.83 | CTSK (0.38) | CTSKCTSLCTSSUSP30CTSB | |
| SCHEMBL6072616 | 0.83 | CTSK (0.40) | CTSKCTSLCTSSUSP30CTSB | |
| SCHEMBL6073055 | 0.82 | CTSL (0.42) | CTSKCTSLCTSSUSP30CTSB | |
| SCHEMBL7012868 | 0.82 | CTSS (0.40) | CTSKCTSLCTSSKMT2AUSP30 | |
| SCHEMBL7011520 | 0.82 | CTSS (0.39) | CTSKCTSLCTSSUSP30CTSB | |
| SCHEMBL7006426 | 0.81 | CTSK (0.53) | CTSKCTSLCTSSALDH1A1USP30 | |
| SCHEMBL7006137 | 0.81 | CTSL (0.39) | CTSKCTSLCTSSUSP30CTSB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1278502-A4 | PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORP (US) | 2003-05-21 | — | — | EP | claimed |
| EP-1278502-A2 | PROTEASE INHIBITORS | SmithKline Beecham Corporation (US) | 2003-01-29 | — | — | EP | claimed |
| WO-2001089451-A2 | PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2001-11-29 | — | — | WO | claimed |