Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRMT5 | O14744 | 2/20 | 0.49 |
| ▸ | CTSS | P25774 | 8/20 | 0.47 |
| ▸ | CTSL | P07711 | 7/20 | 0.47 |
| ▸ | CTSK | P43235 | 4/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6690045 | 0.90 | ALDH1A1 (0.51) | CTSSCTSLCTSKALDH1A1KMT2A | |
| SCHEMBL6688308 | 0.89 | CTSS (0.47) | CTSSCTSLCTSKHTR2BALDH1A1 | |
| SCHEMBL6687888 | 0.83 | EPHX2 (0.51) | CTSSCTSLCTSKKMT2AEPHX2 | |
| SCHEMBL6688266 | 0.82 | HTR2B (0.47) | CTSSCTSLCTSKHTR2BALDH1A1 | |
| SCHEMBL5843145 | 0.82 | CTSS (0.63) | CTSSCTSLCTSK | |
| SCHEMBL5843139 | 0.82 | CTSS (0.63) | CTSSCTSLCTSK | |
| SCHEMBL6692456 | 0.77 | CTSS (0.62) | CTSSCTSLCTSK | |
| SCHEMBL6687973 | 0.77 | EPHX2 (0.50) | CTSSCTSLCTSKKMT2AEPHX2 | |
| SCHEMBL6687678 | 0.76 | CTSS (0.71) | CTSSCTSLCTSKPKM | |
| SCHEMBL6690860 | 0.76 | CTSS (0.61) | CTSSCTSLCTSK |
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 |