Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.45 |
| ▸ | MAPT | P10636 | 8/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | GPR174 | Q9BXC1 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL25539403 | 0.90 | TSHR (0.47) | TSHRMAPK1ALDH1A1MAPTHPGD | |
| SCHEMBL8415604 | 0.85 | ALDH1A1 (0.49) | TSHRMAPK1ALDH1A1MAPTHPGD | |
| SCHEMBL22909290 | 0.80 | MAPK1 (0.50) | TSHRMAPK1ALDH1A1MAPTHPGD | |
| SCHEMBL6205998 | 0.80 | ALDH1A1 (0.55) | TSHRMAPK1ALDH1A1MAPTHPGD | |
| SCHEMBL14283829 | 0.80 | FYN (0.43) | MAPK1ALDH1A1MAPTPKMNPC1 | |
| SCHEMBL9831479 | 0.78 | ALDH1A1 (0.50) | TSHRMAPK1ALDH1A1MAPTHPGD | |
| SCHEMBL8137046 | 0.76 | ALDH1A1 (0.54) | TSHRMAPK1ALDH1A1MAPTHPGD | |
| SCHEMBL8068958 | 0.75 | ALDH1A1 (0.55) | TSHRMAPK1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL8074290 | 0.75 | ALDH1A1 (0.55) | TSHRMAPK1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL8134583 | 0.73 | ALDH1A1 (0.56) | TSHRMAPK1ALDH1A1MAPTHPGD |
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-1532132-A1 | NOVEL BENZODIOXOLES | F.HOFFMANN-LA ROCHE AG (CH) | 2005-05-25 | — | — | EP | disclosed |
| WO-2004013120-A1 | NOVEL BENZODIOXOLES | F. HOFFMANN-LA ROCHE AG (CH) | 2004-02-12 | — | — | WO | disclosed |