Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CTSS | P25774 | 2/20 | 0.31 |
| ▸ | CTSB | P07858 | 1/20 | 0.30 |
| ▸ | CTSK | P43235 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5363249 | 0.93 | CTSS (0.37) | CTSS | |
| SCHEMBL5364780 | 0.85 | CTSB (0.30) | CTSSCTSBCTSK | |
| SCHEMBL5361057 | 0.85 | CTSS (0.35) | CTSSCTSBCTSK | |
| SCHEMBL7075401 | 0.84 | — | — | |
| SCHEMBL5363859 | 0.80 | CTSS (0.37) | CTSSCTSBCTSK | |
| SCHEMBL7071055 | 0.80 | — | — | |
| SCHEMBL5363013 | 0.78 | CTSS (0.39) | CTSSCTSBCTSK | |
| SCHEMBL5362156 | 0.78 | CTSS (0.41) | CTSSCTSBCTSK | |
| SCHEMBL5366950 | 0.77 | CTSB (0.46) | KMT2ACTSSCTSBCTSK | |
| SCHEMBL5361100 | 0.76 | CTSS (0.42) | CTSSCTSBCTSK |
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-1218372-B1 | NOVEL HETEROCYCLIC COMPOUNDS USEFUL AS REVERSIBLE INHIBITORS OF CYSTEINE PROTEASES | BOEHRINGER INGELHEIM PHARMA (US) | 2003-07-02 | — | — | EP | claimed |