Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 5/20 | 0.60 |
| ▸ | PPARG | P37231 | 4/20 | 0.55 |
| ▸ | CTSS | P25774 | 4/20 | 0.51 |
| ▸ | ACE | P12821 | 1/20 | 0.47 |
| ▸ | SYK | P43405 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | PPARD | Q03181 | 2/20 | 0.44 |
| ▸ | CTSK | P43235 | 2/20 | 0.44 |
| ▸ | CTSL | P07711 | 1/20 | 0.44 |
| ▸ | CTSB | P07858 | 1/20 | 0.44 |
| ▸ | KLK7 | P49862 | 1/20 | 0.43 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.43 |
| ▸ | APP | P05067 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | AKT1 | P31749 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8618354 | 1.00 | PPARA (0.60) | PPARAPPARGCTSSACESYK | |
| SCHEMBL1132901 | 0.79 | PPARA (0.90) | PPARAPPARGCTSSACEPPARD | |
| SCHEMBL17051 | 0.79 | PPARA (0.90) | PPARAPPARGCTSSACEPPARD | |
| SCHEMBL828674 | 0.79 | PPARA (0.90) | PPARAPPARGCTSSACEPPARD | |
| SCHEMBL7171467 | 0.78 | PPARA (0.72) | PPARAPPARGCTSSACESYK | |
| SCHEMBL7171472 | 0.78 | PPARA (0.72) | PPARAPPARGCTSSACESYK | |
| SCHEMBL1312604 | 0.77 | PPARA (0.74) | PPARAPPARGCTSSACESYK | |
| SCHEMBL955526 | 0.77 | PPARA (0.74) | PPARAPPARGCTSSACESYK | |
| SCHEMBL20899650 | 0.77 | PPARA (0.82) | PPARAPPARGCTSSACEPPARD | |
| SCHEMBL955527 | 0.77 | PPARA (0.74) | PPARAPPARGCTSSACESYK |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5710324-A | AMINE CONTAINING COMPOUNDS | MERRELL PHARMACEUTICALS INC. (US) | 1998-01-20 | — | — | US | disclosed |
| US-5318992-A | Administering for the treatment of hypotensive conditions and shock | MERRELL DOW PHARMACEUTICALS INC. (US) | 1994-06-07 | — | — | US | disclosed |
| EP-0446699-A1 | Inhibitors of nitric oxide biosynthesis | MERRELL PHARMACEUTICALS INC. (US) | 1991-09-18 | — | — | EP | disclosed |