Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 4/20 | 0.50 |
| ▸ | PPARG | P37231 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.48 |
| ▸ | FBP1 | P09467 | 8/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CALM1 | P0DP23 | 2/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
| ▸ | MGLL | Q99685 | 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 | |
|---|---|---|---|---|
| SCHEMBL1549802 | 0.87 | PPARA (0.50) | PPARAPPARGCYP3A4ABCB11CYP1A2 | |
| SCHEMBL1550074 | 0.80 | PPARA (0.51) | PPARAPPARGCYP3A4ABCB11CYP1A2 | |
| SCHEMBL2964422 | 0.78 | PPARA (0.50) | PPARAPPARGCYP3A4ABCB11CYP1A2 | |
| SCHEMBL12670824 | 0.76 | PPARA (0.62) | PPARAPPARGCYP3A4ABCB11CYP1A2 | |
| SCHEMBL7979408 | 0.75 | PPARA (0.73) | PPARAPPARGCYP3A4ABCB11CYP1A2 | |
| SCHEMBL1549732 | 0.72 | FBP1 (0.72) | PPARACYP3A4ABCB11CYP1A2TSHR | |
| SCHEMBL1549729 | 0.72 | FBP1 (0.72) | PPARACYP3A4ABCB11CYP1A2TSHR | |
| SCHEMBL3484056 | 0.69 | PPARA (0.75) | PPARAPPARGCYP3A4ABCB11CYP1A2 | |
| SCHEMBL63490 | 0.69 | CYP4F2 (0.56) | CYP3A4TSHRSMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL6093013 | 0.69 | PPARA (0.70) | PPARAPPARGCYP3A4ABCB11CYP1A2 |
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-1682508-A1 | PHENYL DERIVATIVES AS PPAR AGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2006-07-26 | — | — | EP | disclosed |
| WO-2005049573-A1 | PHENYL DERIVATIVES AS PPAR AGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2005-06-02 | — | — | WO | disclosed |