Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 9/20 | 0.57 |
| ▸ | CTSL | P07711 | 8/20 | 0.57 |
| ▸ | CTSS | P25774 | 5/20 | 0.57 |
| ▸ | CTSB | P07858 | 2/20 | 0.50 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL21685721 | 0.90 | CTSK (0.56) | CTSKCTSLCTSSCTSBPDE4B | |
| SCHEMBL11906900 | 0.84 | PDE4B (0.49) | CTSKCTSLCTSSPDE4BKMT2A | |
| SCHEMBL11978252 | 0.84 | PDE4B (0.49) | CTSKCTSLCTSSPDE4BKMT2A | |
| SCHEMBL6229850 | 0.83 | CTSK (0.43) | CTSKCTSLCTSSCTSBKMT2A | |
| SCHEMBL7328284 | 0.83 | CTSL (0.47) | CTSKCTSLCTSSPDE4BKMT2A | |
| SCHEMBL2063483 | 0.82 | USP30 (0.58) | CTSKCTSLCTSBPDE4BKMT2A | |
| SCHEMBL2063481 | 0.82 | USP30 (0.58) | CTSKCTSLCTSBPDE4BKMT2A | |
| SCHEMBL6128873 | 0.82 | USP30 (0.58) | CTSKCTSLCTSBPDE4BKMT2A | |
| SCHEMBL7359484 | 0.82 | PDE4B (0.49) | CTSKCTSLCTSSCTSBPDE4B | |
| SCHEMBL764742 | 0.81 | CTSK (0.58) | CTSKCTSLCTSSCTSB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1384713-B1 | 4-amino-azepan-3-one derivatives as protease inhibitors | SMITHKLINE BEECHAM CORP (US) | 2008-10-15 | — | — | EP | disclosed |