Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 2/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.46 |
| ▸ | CDK7 | P50613 | 1/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | GPR35 | Q9HC97 | 3/20 | 0.41 |
| ▸ | FLT3 | P36888 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.41 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | BCR | P11274 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4091567 | 0.93 | AURKA (0.48) | AURKAROCK2ROCK1NPC1RAB9A | |
| SCHEMBL4088217 | 0.91 | AURKA (0.51) | AURKAHDAC6CDK7ROCK2ROCK1 | |
| SCHEMBL4088617 | 0.91 | CDK7 (0.46) | AURKAHDAC6CDK7ROCK2TP53 | |
| SCHEMBL4083473 | 0.90 | PDE2A (0.47) | AURKAHDAC6NPC1RAB9AFLT3 | |
| SCHEMBL4088609 | 0.89 | AURKA (0.49) | AURKAHDAC6CDK7ROCK2ROCK1 | |
| SCHEMBL4092679 | 0.89 | AURKA (0.49) | AURKAHDAC6CDK7ROCK2ROCK1 | |
| SCHEMBL4085444 | 0.86 | AURKA (0.47) | AURKAHDAC6CDK7ROCK2MEN1 | |
| SCHEMBL4093020 | 0.85 | CDC7 (0.44) | AURKAROCK2ROCK1TP53MAPT | |
| SCHEMBL4081942 | 0.85 | KIT (0.54) | AURKAFLT3ABL1BCR | |
| SCHEMBL4078750 | 0.84 | AURKA (0.45) | AURKAHDAC6CDK7ROCK2ROCK1 |
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-2058315-A1 | 1H-Furo[3,2-C]Pyrazoles active as aurora kinase inhibitors | Nerviano Medical Sciences S.r.l. (IT) | 2009-05-13 | — | — | EP | disclosed |