Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KHK | P50053 | 1/20 | 0.46 |
| ▸ | JAK2 | O60674 | 1/20 | 0.44 |
| ▸ | CHUK | O15111 | 2/20 | 0.37 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.36 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.36 |
| ▸ | CDK2 | P24941 | 2/20 | 0.36 |
| ▸ | CDK9 | P50750 | 2/20 | 0.36 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.36 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | KIT | P10721 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9967124 | 0.88 | KHK (0.42) | KHKJAK2CHUKCCNT1CCNA2 | |
| SCHEMBL22883822 | 0.84 | RPS6KA5 (0.46) | KHKCHUKCCNT1CDK2CDK9 | |
| SCHEMBL9967446 | 0.82 | MAP3K14 (0.48) | JAK2CHUKCCNT1CCNA2CDK2 | |
| SCHEMBL17518539 | 0.81 | KHK (0.48) | KHKCHUKMAP3K14 | |
| SCHEMBL8943059 | 0.76 | JAK2 (0.50) | JAK2 | |
| SCHEMBL18306309 | 0.76 | JAK2 (0.53) | JAK2CCNT1CCNA2CDK2CDK9 | |
| SCHEMBL22963816 | 0.74 | GSK3A (0.39) | JAK2CCNT1CDK2CDK9PIK3CA | |
| SCHEMBL17518094 | 0.74 | KHK (0.43) | KHKCHUK | |
| SCHEMBL19124511 | 0.73 | JAK2 (0.35) | JAK2 | |
| SCHEMBL9967235 | 0.73 | CDK2 (0.42) | JAK2CCNT1CCNA2CDK2CDK9 |
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-2012083122-A1 | INHIBITORS OF INFLUENZA VIRUSES REPLICATION | VERTEX PHARMACEUTICAL INCORPORATED (US) | 2012-06-21 | — | — | WO | disclosed |