Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTNNB1 | P35222 | 1/20 | 0.35 |
| ▸ | WNT3A | P56704 | 1/20 | 0.35 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | LIG1 | P18858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6184377 | 0.98 | CTNNB1 (0.34) | CTNNB1WNT3AMRGPRX4MCL1HDAC4 | |
| SCHEMBL6184375 | 0.87 | CTNNB1 (0.31) | CTNNB1WNT3A | |
| SCHEMBL3800470 | 0.80 | CTNNB1 (0.37) | CTNNB1WNT3AMRGPRX4HDAC4CYP1A2 | |
| SCHEMBL22209012 | 0.78 | CTNNB1 (0.38) | CTNNB1WNT3AMRGPRX4HDAC4CYP1A2 | |
| SCHEMBL26290448 | 0.78 | SELL (0.41) | CTNNB1WNT3AMRGPRX4HDAC4CYP1A2 | |
| SCHEMBL6182187 | 0.77 | IDO1 (0.32) | CTNNB1WNT3A | |
| SCHEMBL31739653 | 0.76 | TSHR (0.38) | CTNNB1WNT3AMRGPRX4HDAC4CYP1A2 | |
| SCHEMBL6183181 | 0.75 | MCL1 (0.33) | MCL1CYP1A2PKMLIG1 | |
| SCHEMBL6181368 | 0.73 | DHODH (0.34) | — | |
| SCHEMBL977744 | 0.72 | ALOX5 (0.41) | CTNNB1WNT3AMRGPRX4 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1160244-B1 | Isoxazole derivatives and their use as herbicides | BAYER AGRICULTURE LTD (GB) | 2005-10-19 | — | — | EP | disclosed |
| EP-1160244-A1 | Isoxazole derivatives and their use as herbicides | RHONE-POULENC AGRICULTURE LIMITED (GB) | 2001-12-05 | — | — | EP | disclosed |
| US-5489570-A | PRE- OR POST-EMERGENCE | RHONE-POULENC AGRICULTURE LIMITED (GB) | 1996-02-06 | — | — | US | disclosed |
| WO-1995025099-A1 | 2-CYANO-1,3-DIONE DERIVATIVES USEFUL AS HERBICIDES | RHONE-POULENC AGRICULTURE LTD. (GB) | 1995-09-21 | — | — | WO | disclosed |
| EP-0636622-A1 | Isoxazole derivatives and their use as herbicides | RHONE POULENC AGRICULTURE LTD. (GB) | 1995-02-01 | — | — | EP | disclosed |