Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.33 |
| ▸ | CTSB | P07858 | 2/20 | 0.33 |
| ▸ | CTSS | P25774 | 2/20 | 0.33 |
| ▸ | CTSK | P43235 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | ACE | P12821 | 1/20 | 0.30 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4044323 | 0.91 | SMYD3 (0.33) | SMYD3FKBP1A | |
| SCHEMBL4039560 | 0.91 | HCRTR2 (0.33) | SMYD3CTSBCTSSCTSK | |
| SCHEMBL4045303 | 0.91 | CTSK (0.37) | SMYD3CTSBCTSSCTSKFKBP1A | |
| SCHEMBL4044199 | 0.90 | SMYD3 (0.34) | SMYD3TSHRFKBP1AALDH1A1 | |
| SCHEMBL4052028 | 0.89 | CTSK (0.32) | CTSKMAPTALDH1A1 | |
| SCHEMBL4043912 | 0.88 | CTSK (0.32) | CTSBCTSSCTSKMAPT | |
| SCHEMBL4043944 | 0.88 | CTSK (0.33) | CTSBCTSSCTSKALDH1A1L3MBTL1 | |
| SCHEMBL4040568 | 0.85 | CTSK (0.36) | CTSBCTSSCTSK | |
| SCHEMBL4047167 | 0.83 | USP30 (0.36) | CTSBCTSSCTSK | |
| SCHEMBL4046215 | 0.83 | CHRNB2 (0.34) | SMYD3CTSBCTSSCTSKMAPT |
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 |