Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 8/20 | 0.68 |
| ▸ | PPARG | P37231 | 7/20 | 0.65 |
| ▸ | CTSS | P25774 | 2/20 | 0.53 |
| ▸ | ACE | P12821 | 1/20 | 0.47 |
| ▸ | PPARD | Q03181 | 2/20 | 0.46 |
| ▸ | TACR1 | P25103 | 3/20 | 0.45 |
| ▸ | KLK7 | P49862 | 1/20 | 0.45 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.45 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.44 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.44 |
| ▸ | CTSK | P43235 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.43 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.43 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.43 |
| ▸ | CDC25A | P30304 | 1/20 | 0.43 |
| ▸ | CDC25B | P30305 | 1/20 | 0.43 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.43 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8335300 | 1.00 | PPARA (0.68) | PPARAPPARGCTSSACEPPARD | |
| SCHEMBL12130757 | 0.88 | PPARA (0.85) | PPARAPPARGCTSSACEPPARD | |
| SCHEMBL4995001 | 0.87 | PPARA (0.76) | PPARAPPARGCTSSACEPPARD | |
| SCHEMBL4995012 | 0.87 | PPARA (0.76) | PPARAPPARGCTSSACEPPARD | |
| SCHEMBL1311165 | 0.85 | ACE (0.59) | PPARAPPARGCTSSACEPPARD | |
| SCHEMBL1748947 | 0.85 | ACE (0.59) | PPARAPPARGCTSSACEPPARD | |
| SCHEMBL1529592 | 0.85 | ACE (0.59) | PPARAPPARGCTSSACEPPARD | |
| SCHEMBL5229391 | 0.84 | PPARA (0.65) | PPARAPPARGCTSSACEPPARD | |
| SCHEMBL4997307 | 0.84 | PPARA (0.68) | PPARAPPARGCTSSACEPPARD | |
| SCHEMBL4997319 | 0.84 | PPARA (0.68) | PPARAPPARGCTSSACEPPARD |
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 |
|---|---|---|---|---|---|---|---|
| US-5885999-A | TREATMENT OR PREVENTION OF PAIN, INFLAMMATION, MIGRAINE, EMESIS AND POSTHERPETIC NEURALGIA | MERCK SHARP & DOHME LTD. (GB) | 1999-03-23 | — | — | US | disclosed |
| US-5811431-A | Spiro-substituted azacyclic derivatives and their use as therapeutic agents | MERCK SHARP & DOHME LTD. (GB) | 1998-09-22 | — | — | US | disclosed |