Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 1/20 | 0.53 |
| ▸ | CDK9 | P50750 | 2/20 | 0.46 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.46 |
| ▸ | CDK1 | P06493 | 1/20 | 0.46 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.46 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.46 |
| ▸ | CDK2 | P24941 | 1/20 | 0.46 |
| ▸ | CDK7 | P50613 | 1/20 | 0.46 |
| ▸ | CCNH | P51946 | 1/20 | 0.46 |
| ▸ | JAK2 | O60674 | 2/20 | 0.44 |
| ▸ | JAK3 | P52333 | 2/20 | 0.44 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.44 |
| ▸ | CTSK | P43235 | 4/20 | 0.44 |
| ▸ | CTSS | P25774 | 3/20 | 0.44 |
| ▸ | AURKA | O14965 | 1/20 | 0.43 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.43 |
| ▸ | ABL1 | P00519 | 1/20 | 0.43 |
| ▸ | LCK | P06239 | 1/20 | 0.43 |
| ▸ | MET | P08581 | 1/20 | 0.43 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL17220368 | 0.81 | ROCK1 (0.56) | ROCK1CDK9JAK2JAK3PTK2 | |
| SCHEMBL17219998 | 0.78 | CTSK (0.62) | CTSKCTSSCTSLCTSB | |
| SCHEMBL17219933 | 0.78 | CTSL (0.62) | ROCK1CDK9CDK1CTSKCTSS | |
| SCHEMBL796672 | 0.77 | CTSK (0.61) | CTSK | |
| SCHEMBL17220267 | 0.76 | ROCK1 (0.55) | ROCK1PTK2CTSKCTSSABL1 | |
| SCHEMBL17220225 | 0.75 | ROCK1 (0.50) | ROCK1CDK9CCNT1CDK2JAK2 | |
| SCHEMBL17220223 | 0.75 | ROCK1 (0.50) | ROCK1CDK9CCNT1CDK2JAK2 | |
| SCHEMBL17220228 | 0.75 | ROCK1 (0.50) | ROCK1CDK9CCNT1CDK2JAK2 | |
| SCHEMBL16388190 | 0.75 | ROCK1 (0.50) | ROCK1CDK9CCNT1CDK2JAK2 | |
| SCHEMBL16388552 | 0.74 | ROCK1 (0.49) | ROCK1CDK9CCNT1CDK1CCNB1 |
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-2616465-B1 | TRIAZINE-OXADIAZOLES | NOVARTIS AG (CH) | 2015-11-04 | — | — | EP | disclosed |