Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.35 |
| ▸ | CTSK | P43235 | 2/20 | 0.34 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.33 |
| ▸ | CTSL | P07711 | 1/20 | 0.32 |
| ▸ | CTSS | P25774 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL4045208 | 0.93 | SMYD3 (0.35) | SMYD3FKBP1AALDH1A1CYP2C9TSHR | |
| SCHEMBL4042764 | 0.93 | CTSK (0.38) | SMYD3CTSKFKBP1ACTSLCTSS | |
| SCHEMBL4046102 | 0.90 | KCNQ1 (0.38) | SMYD3CTSKALDH1A1TSHR | |
| SCHEMBL4045926 | 0.89 | GPR132 (0.36) | FKBP1ACTSLCTSS | |
| SCHEMBL4045044 | 0.88 | CTSK (0.36) | CTSK | |
| SCHEMBL4049268 | 0.88 | SMYD3 (0.35) | SMYD3CTSKFKBP1ACTSLCTSS | |
| SCHEMBL4045469 | 0.87 | ELANE (0.37) | CTSKCTSLCTSSALDH1A1 | |
| SCHEMBL4048509 | 0.87 | CTSK (0.38) | CTSKALDH1A1 | |
| SCHEMBL4045645 | 0.86 | SMYD3 (0.34) | SMYD3CTSKFKBP1ACTSLCTSS | |
| SCHEMBL4051200 | 0.83 | CTSK (0.44) | CTSKCTSLCTSS |
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-1546150-B1 | PYRROLE DERIVATIVES AS INHIBITORS OF CYTEINE PROTEASES | AMURA THERAPEUTICS LTD (GB) | 2009-03-04 | — | — | EP | claimed |