Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 3/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.43 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | JAK2 | O60674 | 7/20 | 0.41 |
| ▸ | JAK3 | P52333 | 7/20 | 0.41 |
| ▸ | JAK1 | P23458 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.38 |
| ▸ | MAP3K11 | Q16584 | 1/20 | 0.38 |
| ▸ | PRKDC | P78527 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | ATR | Q13535 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL481589 | 0.81 | MTOR (0.55) | BRD4JAK2JAK3JAK1MAP3K11 | |
| SCHEMBL481329 | 0.76 | MAP3K11 (0.50) | MAP3K11 | |
| SCHEMBL481330 | 0.76 | MAP3K11 (0.50) | MAP3K11 | |
| SCHEMBL481687 | 0.76 | MAP3K11 (0.50) | MAP3K11 | |
| SCHEMBL4635792 | 0.72 | CHRM1 (0.74) | CHRM2CHRM4CHRM1CHRM5CHRM3 | |
| SCHEMBL481598 | 0.72 | MAP3K11 (0.62) | MAP3K11 | |
| Hydrochloric Acid SCHEMBL4635941 | 0.72 | CHRM1 (0.72) | CHRM2CHRM4CHRM1CHRM5CHRM3 | |
| SCHEMBL481696 | 0.72 | MAP3K11 (0.61) | JAK2JAK3JAK1MAP3K11 | |
| SCHEMBL481851 | 0.71 | MAP3K11 (0.53) | JAK2JAK3JAK1MAP3K11 | |
| SCHEMBL15205927 | 0.71 | FYN (0.38) | BRD4MAP3K11PRKDC |
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-2090577-A2 | Heteroaryl compounds, compositions thereof, and their use as protein kinase inhibitors | Signal Pharmaceuticals LLC (US) | 2009-08-19 | — | — | EP | claimed |