Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 2/20 | 0.41 |
| ▸ | SFRP1 | Q8N474 | 4/20 | 0.40 |
| ▸ | WNT3 | P56703 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.38 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | RORC | P51449 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3724316 | 0.76 | ACE (0.41) | CTSSALDH1A1ITGB1ITGA4NPSR1 | |
| SCHEMBL3718279 | 0.74 | ITGB1 (0.40) | CTSSALDH1A1L3MBTL1ITGB1ITGA4 | |
| SCHEMBL3062005 | 0.73 | CTSS (0.49) | CTSSALDH1A1 | |
| SCHEMBL13146441 | 0.69 | CCR2 (0.54) | MCL1 | |
| SCHEMBL3723608 | 0.69 | RORC (0.38) | CTSSITGB1ITGA4RORCHSD11B1 | |
| SCHEMBL17313719 | 0.67 | L3MBTL1 (0.42) | SFRP1WNT3ALDH1A1CA2L3MBTL1 | |
| SCHEMBL14130046 | 0.67 | HCRTR1 (0.39) | ALDH1A1L3MBTL1NPSR1 | |
| SCHEMBL14130218 | 0.67 | HCRTR1 (0.39) | ALDH1A1L3MBTL1NPSR1 | |
| SCHEMBL3065890 | 0.66 | CTSS (0.52) | CTSS | |
| SCHEMBL17428297 | 0.66 | SCN9A (0.61) | — |
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-2010121918-A1 | PROLINE DERIVATIVES AS CATHEPSIN INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-10-28 | — | — | WO | disclosed |