Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.35 |
| ▸ | MC4R | P32245 | 1/20 | 0.35 |
| ▸ | MC3R | P41968 | 1/20 | 0.35 |
| ▸ | MC1R | Q01726 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
| ▸ | TACR1 | P25103 | 1/20 | 0.35 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
| ▸ | HTRA1 | Q92743 | 1/20 | 0.34 |
| ▸ | C3AR1 | Q16581 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4047431 | 0.94 | ALDH1A1 (0.37) | SMYD3 | |
| SCHEMBL4050147 | 0.93 | CTSK (0.40) | SMYD3CTSKFKBP1A | |
| SCHEMBL4043998 | 0.92 | FKBP1A (0.37) | SMYD3CTSKFKBP1A | |
| SCHEMBL4044730 | 0.90 | LMNA (0.39) | CTSK | |
| SCHEMBL4043650 | 0.90 | BMP1 (0.36) | SMYD3 | |
| SCHEMBL4046652 | 0.89 | CHRNB2 (0.35) | SMYD3MC4RMC3RMC1RCTSK | |
| SCHEMBL4040719 | 0.89 | SMYD3 (0.35) | SMYD3CTSKTACR1FKBP1A | |
| SCHEMBL6209230 | 0.89 | CCR1 (0.45) | SMYD3MC4RMC3RMC1RCTSK | |
| SCHEMBL4046863 | 0.88 | SMYD3 (0.35) | SMYD3CTSK | |
| SCHEMBL4051965 | 0.88 | MC4R (0.38) | MC4RMC3RMC1RCTSKTACR1 |
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 |