Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 3/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | GCGR | P47871 | 2/20 | 0.35 |
| ▸ | GLP1R | P43220 | 1/20 | 0.35 |
| ▸ | NR1H4 | Q96RI1 | 4/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6992764 | 0.93 | HPGD (0.39) | HPGDGCGRGLP1RSLC6A3LMNA | |
| SCHEMBL6992598 | 0.92 | AKT1 (0.38) | HPGDGCGRGLP1RSLC6A3 | |
| SCHEMBL6989614 | 0.91 | TP53 (0.47) | TP53THRBMAPTGCGRALDH1A1 | |
| SCHEMBL6986470 | 0.90 | HPGD (0.38) | TP53MAPTHPGDGCGRGLP1R | |
| SCHEMBL6294364 | 0.89 | TP53 (0.38) | TP53THRBMAPTHPGDGCGR | |
| SCHEMBL7144829 | 0.88 | TRPV1 (0.42) | GCGRNR1H4EPHX2 | |
| SCHEMBL6994067 | 0.83 | RAB9A (0.41) | TP53THRBLMNACTSK | |
| SCHEMBL6990244 | 0.83 | TP53 (0.38) | TP53THRBMAPTGCGR | |
| SCHEMBL6988745 | 0.82 | CTSK (0.35) | MAPTHPGDALDH1A1LMNACTSK | |
| SCHEMBL6993081 | 0.82 | CTSK (0.35) | MAPTLMNACTSK |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1358176-A2 | INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES | Amura Therapeutics Limited (GB) | 2003-11-05 | — | — | EP | disclosed |
| WO-2002057246-A2 | INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES | AMURA THERAPEUTICS LIMITED (GB) | 2002-07-25 | — | — | WO | disclosed |