Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | ITGB2 | P05107 | 2/20 | 0.35 |
| ▸ | ICAM1 | P05362 | 2/20 | 0.35 |
| ▸ | ITGAL | P20701 | 2/20 | 0.35 |
| ▸ | ACACB | O00763 | 1/20 | 0.35 |
| ▸ | GPR132 | Q9UNW8 | 3/20 | 0.34 |
| ▸ | CTSK | P43235 | 2/20 | 0.34 |
| ▸ | TNF | P01375 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.34 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.34 |
| ▸ | PREP | P48147 | 1/20 | 0.34 |
| ▸ | FAP | Q12884 | 1/20 | 0.34 |
| ▸ | HTRA1 | Q92743 | 1/20 | 0.34 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.33 |
| ▸ | NR2F2 | P24468 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 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 | |
|---|---|---|---|---|
| SCHEMBL4043031 | 0.93 | HTRA1 (0.37) | ACACBGPR132CTSKHTRA1PAX8 | |
| SCHEMBL4048629 | 0.93 | CTSK (0.42) | ALDH1A1ITGB2ICAM1ITGALACACB | |
| SCHEMBL4047431 | 0.88 | ALDH1A1 (0.37) | ALDH1A1GPR132TNFMAPK1NOD2 | |
| SCHEMBL4047771 | 0.88 | CTSK (0.39) | ACACBGPR132CTSK | |
| SCHEMBL4046542 | 0.87 | POLB (0.36) | ALDH1A1ACACBGPR132CTSKPAX8 | |
| SCHEMBL4045179 | 0.86 | CTSK (0.44) | ITGB2ICAM1ITGALCTSKHTRA1 | |
| SCHEMBL4046989 | 0.85 | ALDH1A1 (0.38) | ALDH1A1MAPK1PREPFAPNR2F2 | |
| SCHEMBL4043616 | 0.85 | CTSK (0.35) | ALDH1A1GPR132CTSKPREPFAP | |
| SCHEMBL4041238 | 0.85 | CHRNB2 (0.36) | ACACBCTSKPREPFAPHTRA1 | |
| SCHEMBL4045929 | 0.85 | PREP (0.36) | ACACBGPR132CTSKPREPFAP |
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 |