Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 7/20 | 0.45 |
| ▸ | CTSK | P43235 | 6/20 | 0.45 |
| ▸ | CTSL | P07711 | 5/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5499131 | 0.88 | CTSS (0.57) | CTSSCTSKCTSLALDH1A1SMN1; SMN2 | |
| SCHEMBL6686917 | 0.86 | CTSS (0.54) | CTSSCTSKCTSLALDH1A1EPHX1 | |
| SCHEMBL6685642 | 0.86 | CTSS (0.54) | CTSSCTSKCTSLALDH1A1EPHX1 | |
| SCHEMBL5404869 | 0.85 | CTSS (0.48) | CTSSCTSKCTSLEPHX1NPC1 | |
| SCHEMBL6686849 | 0.85 | CTSS (0.48) | CTSSCTSKCTSLEPHX1NPC1 | |
| SCHEMBL5841920 | 0.80 | CTSS (0.49) | CTSSCTSKCTSLMAPT | |
| SCHEMBL6689357 | 0.74 | CTSS (0.50) | CTSSCTSKCTSLSMN1; SMN2EPHX1 | |
| SCHEMBL6685640 | 0.73 | TSHR (0.46) | ALDH1A1MAPTEPHX1 | |
| SCHEMBL6685265 | 0.72 | CTSS (0.55) | CTSSCTSKCTSLALDH1A1SMN1; SMN2 | |
| SCHEMBL6694461 | 0.70 | ALDH1A1 (0.54) | CTSSCTSKCTSLALDH1A1SMN1; SMN2 |
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-2004084842-A2 | INHIBITORS OF CATHEPSIN S | IRM LLC (BM) | 2004-10-07 | — | — | WO | disclosed |