Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 4/20 | 0.48 |
| ▸ | CTSK | P43235 | 3/20 | 0.48 |
| ▸ | CTSB | P07858 | 2/20 | 0.48 |
| ▸ | CTSL | P07711 | 2/20 | 0.48 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.47 |
| ▸ | AKT1 | P31749 | 1/20 | 0.47 |
| ▸ | ACE | P12821 | 1/20 | 0.46 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.46 |
| ▸ | CCKAR | P32238 | 4/20 | 0.45 |
| ▸ | CCKBR | P32239 | 4/20 | 0.45 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.42 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6665187 | 0.95 | CTSS (0.45) | CTSSCTSKCTSBCTSLEPHX2 | |
| SCHEMBL6660460 | 0.95 | CTSS (0.45) | CTSSCTSKCTSBCTSLEPHX2 | |
| SCHEMBL6662292 | 0.94 | CTSS (0.46) | CTSSCTSKCTSBCTSLEPHX2 | |
| SCHEMBL6661594 | 0.94 | CTSS (0.46) | CTSSCTSKCTSBCTSLEPHX2 | |
| SCHEMBL6663550 | 0.87 | ITGB3 (0.46) | CTSSCTSKEPHX2AKT1KLK5 | |
| SCHEMBL6662026 | 0.85 | MALT1 (0.45) | EPHX2 | |
| SCHEMBL6658627 | 0.85 | MALT1 (0.45) | EPHX2 | |
| SCHEMBL6659896 | 0.84 | MALT1 (0.44) | KLK5APP | |
| SCHEMBL6664650 | 0.84 | MALT1 (0.44) | KLK5APP | |
| SCHEMBL6663606 | 0.83 | MAPT (0.45) | CTSK |
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-1087935-B1 | ANTHRACENE DERIVATIVES AS ANTI-CANCER AGENTS | BTG INT LTD (GB) | 2004-08-18 | — | — | EP | disclosed |