Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 9/20 | 0.50 |
| ▸ | PPARG | P37231 | 6/20 | 0.50 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.43 |
| ▸ | PPARD | Q03181 | 2/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | FBP1 | P09467 | 2/20 | 0.37 |
| ▸ | STS | P08842 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | PPID | Q08752 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8767770 | 0.92 | PPARA (0.47) | PPARAPPARGABCB11CYP1A2CYP3A4 | |
| SCHEMBL8768939 | 0.84 | PPARA (0.45) | PPARAPPARGABCB11CYP1A2CYP3A4 | |
| SCHEMBL8768870 | 0.83 | PPARA (0.44) | PPARAPPARGABCB11CYP1A2CYP3A4 | |
| SCHEMBL8768890 | 0.77 | PPARA (0.53) | PPARAPPARGABCB11CYP1A2CYP3A4 | |
| SCHEMBL8768094 | 0.77 | PPARA (0.56) | PPARAPPARGABCB11CYP1A2CYP3A4 | |
| SCHEMBL8924428 | 0.75 | PPARA (0.42) | PPARAPPARGABCB11CYP1A2CYP3A4 | |
| SCHEMBL8769015 | 0.75 | PPARA (0.49) | PPARAPPARGABCB11CYP1A2CYP3A4 | |
| SCHEMBL9111447 | 0.73 | PPARA (0.47) | PPARAPPARGPPARDHDAC1HDAC6 | |
| SCHEMBL8768665 | 0.73 | PPARA (0.47) | PPARAPPARGPPARD | |
| SCHEMBL8768641 | 0.72 | PPARA (0.51) | PPARAPPARGABCB11CYP1A2CYP3A4 |
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-0639178-B1 | ANTI-ATHEROSCLEROTIC ARYL COMPOUNDS | WELLCOME FOUND (GB) | 1997-09-03 | — | — | EP | disclosed |
| US-5658944-A | ANTICHOLESTEROL AGENTS | THE UNIVERSITY OF SOUTH CAROLINA (US) | 1997-08-19 | — | — | US | disclosed |