Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 13/20 | 0.40 |
| ▸ | CA1 | P00915 | 3/20 | 0.35 |
| ▸ | CTSS | P25774 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | FDPS | P14324 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17327494 | 1.00 | CTSK (0.40) | CTSKCA1CTSSCA2FDPS | |
| SCHEMBL800009 | 0.79 | MAPK1 (0.31) | CTSK | |
| SCHEMBL1925172 | 0.76 | CTSK (0.46) | CTSKCA1CTSSCA2 | |
| SCHEMBL1299804 | 0.76 | CTSK (0.46) | CTSKCA1CTSSCA2 | |
| Butane SCHEMBL28495596 | 0.74 | CTSK (0.45) | CTSKCA1CTSSCA2 | |
| SCHEMBL19143350 | 0.72 | — | — | |
| SCHEMBL11127472 | 0.71 | CA1 (0.47) | CA1FDPS | |
| SCHEMBL11693847 | 0.71 | CA1 (0.47) | CA1FDPS | |
| SCHEMBL5812132 | 0.71 | CA1 (0.52) | CTSKCA1CA2FDPS | |
| SCHEMBL7373633 | 0.69 | CA1 (0.50) | CTSKCA1CA2FDPS |
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-2010126881-A1 | PROCESSES AND INTERMEDIATES | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2010-11-04 | — | — | WO | disclosed |