Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 8/20 | 0.64 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | PLK1 | P53350 | 4/20 | 0.40 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.34 |
| ▸ | TRPC5 | Q9UL62 | 2/20 | 0.32 |
| ▸ | RET | P07949 | 1/20 | 0.32 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.32 |
| ▸ | PIM1 | P11309 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | CDK9 | P50750 | 1/20 | 0.32 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.32 |
| ▸ | MST1R | Q04912 | 1/20 | 0.32 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.32 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.32 |
| ▸ | CAMK1D | Q8IU85 | 1/20 | 0.32 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.32 |
| ▸ | RORA | P35398 | 1/20 | 0.31 |
| ▸ | RORC | P51449 | 1/20 | 0.31 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.31 |
| ▸ | RORB | Q92753 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6510737 | 0.90 | CHEK1 (0.67) | CHEK1KCNH2PLK1MAPK8PIM1 | |
| SCHEMBL6518261 | 0.90 | CHEK1 (0.66) | CHEK1KCNH2PLK1MAPK8RORA | |
| SCHEMBL6513056 | 0.89 | CHEK1 (0.68) | CHEK1KCNH2PLK1MAPK8RORA | |
| SCHEMBL6513681 | 0.87 | CHEK1 (0.70) | CHEK1KCNH2PLK1MAPK8 | |
| SCHEMBL6515401 | 0.85 | CHEK1 (0.69) | CHEK1KCNH2PLK1MAPK8 | |
| SCHEMBL6518250 | 0.84 | CHEK1 (0.61) | CHEK1KCNH2PLK1MAPK8PIM1 | |
| SCHEMBL6522826 | 0.84 | CHEK1 (0.74) | CHEK1KCNH2PLK1MAPK8RORA | |
| SCHEMBL6519912 | 0.84 | CHEK1 (0.68) | CHEK1KCNH2PLK1MAPK8 | |
| SCHEMBL6513422 | 0.82 | CHEK1 (0.71) | CHEK1KCNH2PLK1MAPK8RORA | |
| SCHEMBL6517718 | 0.82 | CHEK1 (0.77) | CHEK1KCNH2PLK1RORARORC |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1549648-A1 | BICYCLIC HETEROAROMATIC COMPOUNDS AS KINASE INHIBITORS | Celltech R & D Limited (GB) | 2005-07-06 | — | — | EP | disclosed |
| WO-2005028474-A2 | PYRAZOLOQUINOLINE DERIVATIVES AS CHK-1 INHIBITORS | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2005-03-31 | — | — | WO | disclosed |
| WO-2004031188-A1 | BICYCLIC HETEROAROMATIC COMPOUNDS AS KINASE INHIBITORS | CELLTECH R & D LIMITED (GB) | 2004-04-15 | — | — | WO | disclosed |