Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | IKBKB | O14920 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL8490478 | 1.00 | ALDH1A1 (0.37) | ALDH1A1MAPK1HTTIKBKBPOLB | |
| SCHEMBL8491940 | 0.89 | ALDH1A1 (0.36) | ALDH1A1HTT | |
| SCHEMBL8491938 | 0.89 | ALDH1A1 (0.36) | ALDH1A1HTT | |
| SCHEMBL8495597 | 0.88 | IKBKB (0.36) | ALDH1A1MAPK1HTTIKBKBPOLB | |
| SCHEMBL8495594 | 0.88 | IKBKB (0.36) | ALDH1A1MAPK1HTTIKBKBPOLB | |
| SCHEMBL8490481 | 0.85 | IKBKB (0.35) | ALDH1A1MAPK1HTTIKBKBPOLB | |
| SCHEMBL8492582 | 0.83 | ALDH1A1 (0.35) | ALDH1A1MAPK1HTTIKBKBPOLB | |
| SCHEMBL8492577 | 0.83 | ALDH1A1 (0.35) | ALDH1A1MAPK1HTTIKBKBPOLB | |
| SCHEMBL8686478 | 0.81 | — | — | |
| SCHEMBL8887843 | 0.81 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5747424-A | HEATING AN AROMATIC DIKETONE WITH A SALT OF HYDROXYLAMINE IN A SOLVENT | RHONE-POULENC AGRICULTURE LTD. (GB) | 1998-05-05 | — | — | US | disclosed |
| US-5656573-A | Herbicidal 4-substituted isoxazoles | RHONE-POULENC AGRICULTURE LTD. (GB) | 1997-08-12 | — | — | US | disclosed |
| US-5650533-A | Intermediates to herbicidal 4-substituted isoxazoles | RHONE-POULENC AGRICULTURE LTD. (GB) | 1997-07-22 | — | — | US | disclosed |
| EP-0418175-B1 | Isoxazoles herbicides | RHONE POULENC AGRICULTURE (GB) | 1996-07-17 | — | — | EP | disclosed |
| EP-0418175-A2 | Isoxazoles herbicides | RHONE POULENC AGRICULTURE LTD. (GB) | 1991-03-20 | — | — | EP | disclosed |