Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | SLC8A1 | P32418 | 6/20 | 0.38 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.36 |
| ▸ | PRKCG | P05129 | 1/20 | 0.36 |
| ▸ | PRKACA | P17612 | 1/20 | 0.36 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.36 |
| ▸ | CLK2 | P49760 | 1/20 | 0.36 |
| ▸ | GSK3A | P49840 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.36 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.36 |
| ▸ | PRKG1 | Q13976 | 1/20 | 0.36 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.36 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.36 |
| ▸ | SGK2 | Q9HBY8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL24669890 | 0.86 | ULK1 (0.37) | ALDH1A1CCNT1CDK9ULK1HRH3 | |
| SCHEMBL31704847 | 0.84 | CRBN (0.37) | MAPK1CCNT1CDK9HRH3NAMPT | |
| SCHEMBL31706252 | 0.84 | CRBN (0.37) | MAPK1CCNT1CDK9HRH3NAMPT | |
| SCHEMBL24671230 | 0.79 | NAMPT (0.51) | CCNT1CDK9NAMPTQDPR | |
| SCHEMBL24669893 | 0.77 | SLC6A3 (0.43) | NAMPT | |
| SCHEMBL24670471 | 0.75 | SLC6A3 (0.42) | NAMPT | |
| Trifluoroacetic Acid SCHEMBL29803405 | 0.73 | PTPN11 (0.47) | ULK1NAMPTQDPR | |
| SCHEMBL15001490 | 0.71 | HRH3 (0.42) | ALDH1A1HRH3QDPR | |
| Trifluoroacetic Acid SCHEMBL29803567 | 0.70 | SLC6A3 (0.40) | ULK1NAMPT | |
| SCHEMBL12788246 | 0.70 | NPC1 (0.57) | MAPK1TP53ALDH1A1DYRK3PRKCG |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022192162-A1 | NOVEL HETEROAROMATIC COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE | FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) | 2022-09-15 | — | — | WO | disclosed |