Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.39 |
| ▸ | PRKAB2 | O43741 | 2/20 | 0.39 |
| ▸ | NUAK1 | O60285 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | PRKAG1 | P54619 | 2/20 | 0.39 |
| ▸ | PRKAA2 | P54646 | 2/20 | 0.39 |
| ▸ | PRKAA1 | Q13131 | 2/20 | 0.39 |
| ▸ | MELK | Q14680 | 2/20 | 0.39 |
| ▸ | CAMKK2 | Q96RR4 | 2/20 | 0.39 |
| ▸ | PRKAG3 | Q9UGI9 | 2/20 | 0.39 |
| ▸ | PRKAG2 | Q9UGJ0 | 2/20 | 0.39 |
| ▸ | PRKAB1 | Q9Y478 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL436539 | 0.89 | DRD4 (0.50) | DRD4ALDH1A1HRH3CHEK1PRKAB2 | |
| SCHEMBL4487965 | 0.86 | DRD4 (0.50) | DRD4ALDH1A1POLBHRH3CHEK1 | |
| SCHEMBL3158672 | 0.85 | DRD4 (0.49) | DRD4ALDH1A1HRH3LMNAPPIB | |
| SCHEMBL30921473 | 0.85 | DRD4 (0.49) | DRD4ALDH1A1HRH3MAPK1LMNA | |
| SCHEMBL24538671 | 0.84 | DRD4 (0.49) | DRD4ALDH1A1HRH3CHEK1PRKAB2 | |
| SCHEMBL17976248 | 0.84 | DRD4 (0.47) | DRD4ALDH1A1POLBLMNAHSD17B10 | |
| SCHEMBL3148838 | 0.84 | DRD4 (0.48) | DRD4ALDH1A1HRH3LMNAPPIB | |
| SCHEMBL4490990 | 0.84 | DRD4 (0.46) | DRD4HRH3CHEK1PRKAB2NUAK1 | |
| SCHEMBL3144650 | 0.82 | HRH3 (0.58) | DRD4ALDH1A1HRH3MAPK1LMNA | |
| SCHEMBL18851564 | 0.82 | DRD4 (0.46) | DRD4ALDH1A1HRH3CHEK1PRKAB2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3056202-A1 | BENZOPYRROLIDONE DERIVATIVES POSSESSING ANTIVIRAL AND ANTICANCER PROPERTIES | Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2016-08-17 | — | — | EP | disclosed |