Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 11/20 | 0.41 |
| ▸ | MMP2 | P08253 | 2/20 | 0.40 |
| ▸ | MMP3 | P08254 | 2/20 | 0.40 |
| ▸ | CTSB | P07858 | 4/20 | 0.39 |
| ▸ | CTSL | P07711 | 3/20 | 0.39 |
| ▸ | CTSH | P09668 | 2/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10119291 | 0.90 | CTSK (0.48) | CTSKCTSBCTSLCTSH | |
| SCHEMBL10118858 | 0.82 | MAOA (0.39) | CTSB | |
| SCHEMBL10118924 | 0.76 | CA2 (0.49) | — | |
| SCHEMBL12516670 | 0.76 | CTSB (0.51) | CTSKMMP2MMP3CTSBCTSL | |
| SCHEMBL13020074 | 0.75 | CASP1 (0.50) | MMP2MMP3CTSB | |
| SCHEMBL13970541 | 0.75 | CTSB (0.46) | CTSB | |
| SCHEMBL13951082 | 0.75 | CASP1 (0.50) | MMP2MMP3CTSB | |
| SCHEMBL10118863 | 0.72 | CTSK (0.57) | CTSKCTSBCTSLCTSH | |
| SCHEMBL10118860 | 0.72 | CTSK (0.57) | CTSKCTSBCTSLCTSH | |
| SCHEMBL10118861 | 0.72 | CTSK (0.57) | CTSKCTSBCTSLCTSH |
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-2012004554-A1 | ALDEHYDE COMPOUNDS AS INHIBITORS OF DUST MITE GROUP 1 PEPTIDASE ALLERGEN AND THEIR USE | ST GEORGE'S HOSPITAL MEDICAL SCHOOL (GB) | 2012-01-12 | — | — | WO | disclosed |