Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SYK | P43405 | 3/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | MAP4K1 | Q92918 | 2/20 | 0.36 |
| ▸ | JAK3 | P52333 | 4/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.34 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.34 |
| ▸ | PRKCI | P41743 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 2/20 | 0.33 |
| ▸ | JAK1 | P23458 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.33 |
| ▸ | ATR | Q13535 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2277537 | 0.88 | SYK (0.44) | SYKCYP2C9MAP4K1JAK3JAK2 | |
| SCHEMBL2341691 | 0.87 | SYK (0.43) | SYKCYP2C9MAP4K1JAK3CREBBP | |
| SCHEMBL2344505 | 0.85 | MAP4K1 (0.36) | SYKCYP2C9MAP4K1JAK3MAPK1 | |
| SCHEMBL2344717 | 0.84 | SYK (0.37) | SYKCYP2C9MAP4K1JAK3MAPK1 | |
| SCHEMBL2341503 | 0.84 | JAK3 (0.39) | SYKCYP2C9MAP4K1JAK3PRKCI | |
| SCHEMBL2349820 | 0.83 | ATR (0.45) | JAK3PRKCIJAK2ATRHSD17B10 | |
| SCHEMBL2348276 | 0.83 | SYK (0.38) | SYKMAP4K1PRKCI | |
| SCHEMBL2275385 | 0.79 | SYK (0.55) | SYKCYP2C9JAK3JAK2JAK1 | |
| SCHEMBL2343568 | 0.79 | CNR2 (0.40) | SYKCREBBPJAK2ATR | |
| SCHEMBL2274335 | 0.77 | SYK (0.41) | SYKCYP2C9JAK3MAPK1PRKCI |
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-2245033-B1 | PYRROLOPYRAZINE KINASE INHIBITORS | HOFFMANN LA ROCHE (CH) | 2011-08-31 | — | — | EP | claimed |