Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 5/20 | 0.39 |
| ▸ | CCR1 | P32246 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP3 | P08254 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 3/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | CTSL | P07711 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6466334 | 0.99 | CCR1 (0.39) | CTSSCCR1NPC1RAB9ABACE1 | |
| SCHEMBL6465743 | 0.91 | CTSS (0.40) | CTSSCCR1BACE1LMNACTSL | |
| SCHEMBL6462669 | 0.83 | CCR1 (0.35) | CTSSCCR1NPC1RAB9AMMP1 | |
| SCHEMBL6462284 | 0.82 | PTPN1 (0.39) | CCR1FAAHLMNAMAPT | |
| SCHEMBL6467437 | 0.78 | PTPN1 (0.41) | NPC1RAB9A | |
| SCHEMBL7045440 | 0.76 | HPGD (0.41) | CTSSNPC1RAB9ABACE1ALDH1A1 | |
| SCHEMBL6473317 | 0.72 | MMP1 (0.40) | CTSSCCR1NPC1RAB9AMMP1 | |
| SCHEMBL7045920 | 0.70 | CTSL (0.40) | CTSSNPC1RAB9ABACE1ALDH1A1 | |
| SCHEMBL5671353 | 0.69 | MMP2 (0.36) | CTSSCCR1NPC1RAB9AMMP1 | |
| SCHEMBL6468626 | 0.67 | CTSS (0.44) | CTSSCCR1NPC1RAB9AMMP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1516877-A1 | Amine derivatives as protease inhibitors | AXYS PHARMACEUTICALS, INC. (US) | 2005-03-23 | — | — | EP | disclosed |