Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | CTSV | O60911 | 1/20 | 0.33 |
| ▸ | CTSL | P07711 | 1/20 | 0.33 |
| ▸ | CTSB | P07858 | 1/20 | 0.33 |
| ▸ | CTSS | P25774 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL5099273 | 0.87 | CTSK (0.40) | ALDH1A1CTSKTSHRCTSVCTSL | |
| SCHEMBL5092868 | 0.86 | CTSK (0.35) | SMN1; SMN2ALDH1A1CTSKTSHRCTSV | |
| SCHEMBL6237786 | 0.85 | CTSL (0.39) | SMN1; SMN2ALDH1A1HTTCYP3A4RECQL | |
| SCHEMBL4791147 | 0.84 | CTSK (0.32) | CTSKCTSVCTSLCTSBCTSS | |
| SCHEMBL6255813 | 0.83 | CYP3A4 (0.39) | SMN1; SMN2ALDH1A1HTTCYP3A4CTSK | |
| SCHEMBL5098864 | 0.83 | KMT2A (0.39) | SMN1; SMN2ALDH1A1NPC1CTSKTSHR | |
| SCHEMBL4767047 | 0.80 | CTSK (0.42) | CTSKCTSVCTSLCTSBCTSS | |
| SCHEMBL6236079 | 0.80 | CTSK (0.42) | SMN1; SMN2ALDH1A1HTTCYP3A4RECQL | |
| SCHEMBL6404947 | 0.80 | CTSK (0.44) | CTSKCTSVCTSLCTSBCTSS | |
| SCHEMBL5098737 | 0.80 | ALDH1A1 (0.41) | ALDH1A1CTSKTSHRCTSVCTSL |
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-2005013909-A2 | NOVEL CATHEPSIN K INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2005-02-17 | — | — | WO | disclosed |