Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 3/20 | 0.47 |
| ▸ | CTSS | P25774 | 15/20 | 0.47 |
| ▸ | FAAH | O00519 | 2/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 1/20 | 0.42 |
| ▸ | CTSB | P07858 | 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 | |
|---|---|---|---|---|
| SCHEMBL6465141 | 0.87 | CTSS (0.48) | CTSKCTSSFAAHCES1CYP3A4 | |
| SCHEMBL6463419 | 0.87 | CTSS (0.48) | CTSKCTSSFAAHCES1CYP3A4 | |
| SCHEMBL6468629 | 0.87 | CTSS (0.48) | CTSKCTSSFAAHCES1CYP3A4 | |
| SCHEMBL6464884 | 0.86 | CTSS (0.49) | CTSKCTSSFAAHCES1CYP3A4 | |
| SCHEMBL6463201 | 0.84 | CTSS (0.47) | CTSSFAAH | |
| SCHEMBL7049546 | 0.83 | CTSK (0.51) | CTSKCTSSCYP3A4CYP2C9CTSL | |
| SCHEMBL5416092 | 0.79 | CTSS (0.48) | CTSKCTSSCYP3A4CYP2C9 | |
| SCHEMBL6464300 | 0.78 | CTSS (0.44) | CTSKCTSSCTSLCTSB | |
| SCHEMBL7045308 | 0.78 | CTSS (0.49) | CTSKCTSSCTSLCTSB | |
| SCHEMBL7049425 | 0.78 | CTSL (0.49) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1516877-A1 | Amine derivatives as protease inhibitors | AXYS PHARMACEUTICALS, INC. (US) | 2005-03-23 | — | — | EP | disclosed |