Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | MMP8 | P22894 | 2/20 | 0.33 |
| ▸ | MMP3 | P08254 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.33 |
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.32 |
| ▸ | CTSK | P43235 | 2/20 | 0.32 |
| ▸ | CTSS | P25774 | 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 | |
|---|---|---|---|---|
| SCHEMBL4043393 | 0.93 | FKBP1A (0.35) | CHRNB2CHRNA7CHRNA4FKBP1ASMYD3 | |
| SCHEMBL4043638 | 0.90 | ALDH1A1 (0.35) | CHRNB2CHRNA7CHRNA4MMP3ALDH1A1 | |
| SCHEMBL4042306 | 0.90 | MMP8 (0.37) | CHRNA7MMP8MMP3ALDH1A1CTSK | |
| SCHEMBL4046884 | 0.89 | CTSK (0.34) | CHRNB2CHRNA7CHRNA4MMP3ALDH1A1 | |
| SCHEMBL4042787 | 0.88 | CHRNB2 (0.37) | CHRNB2CHRNA7CHRNA4ALDH1A1CTSK | |
| SCHEMBL4045076 | 0.87 | ALDH1A1 (0.38) | ALDH1A1CTSKCTSS | |
| SCHEMBL4040719 | 0.86 | SMYD3 (0.35) | ALDH1A1FKBP1ASMYD3CTSKCTSS | |
| SCHEMBL4050153 | 0.86 | SMYD3 (0.35) | ALDH1A1FKBP1ASMYD3 | |
| SCHEMBL4044003 | 0.86 | CTSK (0.40) | CHRNB2CHRNA7CHRNA4FKBP1ACTSK | |
| SCHEMBL4044090 | 0.85 | CTSK (0.34) | MMP8MMP3ALDH1A1CTSK |
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 |