Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | CTSB | P07858 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | CRHBP | P24387 | 1/20 | 0.44 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.44 |
| ▸ | APP | P05067 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL5667641 | 0.84 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2HPGDTSHRMAPK1 | |
| SCHEMBL27556368 | 0.83 | ALDH1A1 (0.51) | ALDH1A1GPR35SMN1; SMN2TP53HPGD | |
| SCHEMBL899647 | 0.82 | ALDH1A1 (0.50) | ALDH1A1GPR35SMN1; SMN2TP53HPGD | |
| SCHEMBL899648 | 0.82 | ALDH1A1 (0.50) | ALDH1A1GPR35SMN1; SMN2TP53HPGD | |
| SCHEMBL863466 | 0.81 | GPR35 (0.51) | ALDH1A1GPR35SMN1; SMN2TP53HPGD | |
| SCHEMBL28026694 | 0.81 | TDP1 (0.49) | ALDH1A1GPR35SMN1; SMN2TP53HPGD | |
| SCHEMBL8398671 | 0.81 | TDP1 (0.49) | ALDH1A1GPR35SMN1; SMN2TP53HPGD | |
| SCHEMBL27463698 | 0.80 | SMN1; SMN2 (0.53) | ALDH1A1GPR35SMN1; SMN2TP53HPGD | |
| SCHEMBL4369634 | 0.79 | CYP1A2 (0.53) | ALDH1A1GPR35SMN1; SMN2TP53HPGD | |
| SCHEMBL1470136 | 0.78 | TSHR (0.55) | ALDH1A1GPR35SMN1; SMN2TP53HPGD |
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 |