Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.49 |
| ▸ | MAPK14 | Q16539 | 8/20 | 0.48 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.44 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.41 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.40 |
| ▸ | NOS3 | P29474 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL22570017 | 0.87 | KDM4E (0.47) | ALDH1A1KDM4EL3MBTL1MAPK1MALT1 | |
| SCHEMBL23573503 | 0.86 | MAPK14 (0.46) | ALDH1A1KDM4EL3MBTL1MAPK1MALT1 | |
| SCHEMBL2710597 | 0.77 | ALDH1A1 (0.53) | ALDH1A1KDM4EL3MBTL1MAPK1MALT1 | |
| SCHEMBL16974188 | 0.77 | ALDH1A1 (0.53) | ALDH1A1KDM4EL3MBTL1MAPK1MALT1 | |
| SCHEMBL827883 | 0.77 | ALDH1A1 (0.83) | ALDH1A1KDM4EL3MBTL1MAPK1MALT1 | |
| SCHEMBL12465906 | 0.73 | CDC7 (0.51) | ALDH1A1KDM4EL3MBTL1MAPK1MAPK14 | |
| SCHEMBL14804466 | 0.73 | ALDH1A1 (0.53) | ALDH1A1KDM4EL3MBTL1MAPK1MALT1 | |
| SCHEMBL18232562 | 0.73 | MAPK1 (0.57) | ALDH1A1KDM4EL3MBTL1MAPK1MALT1 | |
| SCHEMBL24473806 | 0.73 | ALDH1A1 (0.49) | ALDH1A1KDM4EL3MBTL1MAPK1MALT1 | |
| SCHEMBL24473804 | 0.72 | HCAR3 (0.61) | ALDH1A1KDM4EL3MBTL1MAPK14NOS3 |
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-2545050-A1 | COMPOUNDS FOR THE TREATMENT OF HEPATITIS C | Bristol-Myers Squibb Company (US) | 2013-01-16 | — | — | EP | disclosed |
| WO-2011112186-A1 | COMPOUNDS FOR THE TREATMENT OF HEPATITIS C | BRISTOL-MYERS SQUIBB COMPANY (US) | 2011-09-15 | — | — | WO | disclosed |