Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 1/20 | 0.46 |
| ▸ | CDK1 | P06493 | 1/20 | 0.46 |
| ▸ | CDK4 | P11802 | 1/20 | 0.46 |
| ▸ | CDK2 | P24941 | 1/20 | 0.46 |
| ▸ | AKT1 | P31749 | 1/20 | 0.46 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.41 |
| ▸ | NQO2 | P16083 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | RAD52 | P43351 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TDP2 | O95551 | 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 | |
|---|---|---|---|---|
| SCHEMBL18079552 | 0.82 | AURKA (0.52) | AURKACDK1CDK4CDK2AKT1 | |
| SCHEMBL9006232 | 0.80 | AURKA (0.50) | AURKACDK1CDK4CDK2AKT1 | |
| SCHEMBL9006085 | 0.78 | POLB (0.49) | AURKACDK1CDK4CDK2AKT1 | |
| SCHEMBL9006235 | 0.73 | HPGD (0.49) | AURKACDK1CDK4CDK2AKT1 | |
| SCHEMBL9006179 | 0.71 | PPARA (0.46) | AURKACDK1CDK4CDK2AKT1 | |
| SCHEMBL9006329 | 0.69 | NUDT1 (0.41) | AURKACDK1CDK4CDK2AKT1 | |
| SCHEMBL22608957 | 0.69 | NUDT1 (0.50) | AURKACDK1CDK4CDK2AKT1 | |
| SCHEMBL15574603 | 0.69 | NUDT1 (0.60) | AURKACDK1CDK4CDK2AKT1 | |
| SCHEMBL8588698 | 0.69 | GSK3A (0.52) | AURKACDK1CDK4CDK2AKT1 | |
| SCHEMBL15574808 | 0.68 | NUDT1 (0.60) | AURKACDK1CDK4CDK2AKT1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5506236-A | TREATING HERPES VIRUS INFECTIONS | SCHERING CORPORATION | 1996-04-09 | — | — | US | disclosed |