Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 5/20 | 0.36 |
| ▸ | CTSS | P25774 | 3/20 | 0.36 |
| ▸ | PAM | P19021 | 2/20 | 0.31 |
| ▸ | DGKA | P23743 | 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 | |
|---|---|---|---|---|
| SCHEMBL4869137 | 0.85 | CTSK (0.37) | CTSKCTSS | |
| SCHEMBL6818847 | 0.82 | CYP1A2 (0.42) | PAMDGKA | |
| SCHEMBL4861183 | 0.81 | CTSK (0.36) | CTSKCTSSDGKA | |
| SCHEMBL6819014 | 0.81 | CTSK (0.30) | CTSK | |
| SCHEMBL4870531 | 0.79 | CTSS (0.35) | CTSKCTSSDGKA | |
| SCHEMBL4870067 | 0.76 | CTSK (0.35) | CTSKCTSS | |
| SCHEMBL24894291 | 0.75 | FDPS (0.36) | CTSKPAMDGKA | |
| SCHEMBL1003368 | 0.74 | CES1 (0.46) | CTSKPAMDGKA | |
| SCHEMBL11857578 | 0.74 | TSHR (0.41) | — | |
| SCHEMBL522691 | 0.73 | DGKA (0.54) | PAMDGKA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004020399-A1 | MALONONITRILE COMPOUND AND USE THEREOF AS PESTICIDES | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2004-03-11 | — | — | WO | disclosed |