Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | PREP | P48147 | 1/20 | 0.35 |
| ▸ | FAP | Q12884 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 4/20 | 0.34 |
| ▸ | NR2F2 | P24468 | 2/20 | 0.34 |
| ▸ | PPARG | P37231 | 1/20 | 0.34 |
| ▸ | PPARA | Q07869 | 1/20 | 0.34 |
| ▸ | MC4R | P32245 | 1/20 | 0.34 |
| ▸ | MC3R | P41968 | 1/20 | 0.34 |
| ▸ | MC1R | Q01726 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 3/20 | 0.33 |
| ▸ | GALR3 | O60755 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL4047535 | 0.95 | MC4R (0.38) | PREPFAPMC4RMC3RMC1R | |
| SCHEMBL4043226 | 0.93 | CTSK (0.40) | ALDH1A1RAB9ALMNACTSKCTSL | |
| SCHEMBL4046799 | 0.90 | ALDH1A1 (0.39) | ALDH1A1PREPFAPCTSKCTSL | |
| SCHEMBL4044339 | 0.90 | ALDH1A1 (0.37) | ALDH1A1PREPFAPRAB9ANR2F2 | |
| SCHEMBL4052303 | 0.89 | CTSK (0.35) | PREPFAPMC4RMC3RMC1R | |
| SCHEMBL4049188 | 0.89 | CTSK (0.40) | ALDH1A1PREPFAPRAB9ANR2F2 | |
| SCHEMBL4039771 | 0.88 | ALDH1A1 (0.38) | ALDH1A1PREPFAPRAB9ANR2F2 | |
| SCHEMBL4046061 | 0.88 | LMNA (0.36) | ALDH1A1PREPFAPRAB9ALMNA | |
| SCHEMBL4043256 | 0.87 | CTSK (0.41) | ALDH1A1MC4RMC3RMC1RCTSK | |
| SCHEMBL4043203 | 0.87 | CTSK (0.35) | ALDH1A1PREPFAPRAB9AMC4R |
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 |