Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP3 | P08254 | 7/20 | 0.44 |
| ▸ | CTSL | P07711 | 2/20 | 0.43 |
| ▸ | CTSB | P07858 | 2/20 | 0.43 |
| ▸ | CTSS | P25774 | 2/20 | 0.43 |
| ▸ | CTSK | P43235 | 2/20 | 0.43 |
| ▸ | MMP2 | P08253 | 2/20 | 0.43 |
| ▸ | MMP8 | P22894 | 2/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | ANPEP | P15144 | 1/20 | 0.42 |
| ▸ | DAGLA | Q9Y4D2 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6464784 | 0.95 | ANPEP (0.48) | MMP3CTSLCTSBCTSSCTSK | |
| SCHEMBL6063167 | 0.90 | CTSL (0.51) | MMP3CTSLCTSBCTSSCTSK | |
| SCHEMBL6466269 | 0.88 | MMP9 (0.44) | MMP3CTSLCTSBCTSSCTSK | |
| SCHEMBL6464783 | 0.88 | MMP9 (0.44) | MMP3CTSLCTSBCTSSCTSK | |
| SCHEMBL6466271 | 0.88 | MMP9 (0.44) | MMP3CTSLCTSBCTSSCTSK | |
| SCHEMBL6063868 | 0.85 | PSMB5 (0.44) | MMP3CTSLCTSBCTSSCTSK | |
| SCHEMBL6061873 | 0.85 | CA5A (0.53) | MMP3CTSLCTSBCTSSCTSK | |
| SCHEMBL6064394 | 0.85 | CA5A (0.53) | MMP3CTSLCTSBCTSSCTSK | |
| SCHEMBL6463220 | 0.82 | CTSL (0.51) | MMP3CTSLCTSBCTSSCTSK | |
| SCHEMBL6464780 | 0.81 | CTSB (0.42) | MMP3CTSLCTSBCTSSCTSK |
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 |