Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ULK1 | O75385 | 4/20 | 0.70 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.60 |
| ▸ | ULK2 | Q8IYT8 | 1/20 | 0.60 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.59 |
| ▸ | SRC | P12931 | 3/20 | 0.57 |
| ▸ | GSK3B | P49841 | 3/20 | 0.57 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.57 |
| ▸ | IGF1R | P08069 | 5/20 | 0.56 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.56 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.56 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.51 |
| ▸ | CDK2 | P24941 | 1/20 | 0.51 |
| ▸ | AURKA | O14965 | 1/20 | 0.51 |
| ▸ | PAK4 | O96013 | 1/20 | 0.51 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL12430688 | 0.87 | ULK1 (0.73) | ULK1PDK1ULK2NTRK1SRC | |
| SCHEMBL31471925 | 0.87 | ULK1 (0.73) | ULK1PDK1ULK2NTRK1SRC | |
| SCHEMBL12430679 | 0.87 | NTRK1 (0.64) | ULK1PDK1ULK2NTRK1SRC | |
| SCHEMBL31471760 | 0.86 | ULK1 (0.77) | ULK1PDK1ULK2NTRK1SRC | |
| SCHEMBL31471779 | 0.86 | ULK1 (0.86) | ULK1PDK1ULK2NTRK1SRC | |
| SCHEMBL12430667 | 0.86 | ULK1 (0.86) | ULK1PDK1ULK2NTRK1SRC | |
| SCHEMBL31471747 | 0.85 | ULK1 (0.72) | ULK1PDK1ULK2NTRK1SRC | |
| SCHEMBL31471775 | 0.84 | ULK1 (0.77) | ULK1PDK1ULK2NTRK1SRC | |
| SCHEMBL31471862 | 0.84 | ULK1 (0.73) | ULK1PDK1ULK2NTRK1SRC | |
| SCHEMBL2203442 | 0.84 | ULK1 (0.49) | ULK1PDK1ULK2SRCGSK3B |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7625913-B2 | Pyrazole compounds useful as protein kinase inhibitors | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2009-12-01 | — | — | US | disclosed |
| US-7625913-B2 | Pyrazole compounds useful as protein kinase inhibitors | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2009-12-01 | — | — | US | disclosed |
| US-7531536-B2 | Pyrazole compounds useful as protein kinase inhibitors | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2009-05-12 | — | — | US | disclosed |
| US-7531536-B2 | Pyrazole compounds useful as protein kinase inhibitors | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2009-05-12 | — | — | US | disclosed |