Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K1 | Q92918 | 2/20 | 0.35 |
| ▸ | SYK | P43405 | 8/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.33 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.33 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.32 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.31 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.31 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | JAK3 | P52333 | 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 | |
|---|---|---|---|---|
| SCHEMBL3393919 | 0.91 | MAP4K1 (0.40) | MAP4K1SYKCYP2C9MAPTUSP2 | |
| SCHEMBL3399808 | 0.91 | MAP4K1 (0.37) | MAP4K1SYKCYP2C9MAPTALDH1A1 | |
| SCHEMBL3398989 | 0.89 | MAP4K1 (0.38) | MAP4K1SYKCYP2C9KCNH2CYP2D6 | |
| SCHEMBL3399615 | 0.88 | MAP4K1 (0.35) | MAP4K1SYKCYP2C9KCNH2CYP2D6 | |
| SCHEMBL3395780 | 0.86 | MAP4K1 (0.34) | MAP4K1SYKKCNH2CYP2D6 | |
| SCHEMBL3396851 | 0.85 | SYK (0.36) | MAP4K1SYKKCNH2CYP2D6 | |
| SCHEMBL3398570 | 0.85 | SYK (0.35) | MAP4K1SYKCYP2C9KCNH2JAK3 | |
| SCHEMBL3397319 | 0.83 | MAP4K1 (0.39) | MAP4K1SYKCYP2C9ALDH1A1ABL1 | |
| SCHEMBL3396231 | 0.83 | BTK (0.33) | MAP4K1SYKCYP2C9KCNH2JAK3 | |
| SCHEMBL3396369 | 0.82 | MAP4K1 (0.33) | MAP4K1SYKKCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2245033-A1 | PYRROLOPYRAZINE KINASE INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2010-11-03 | — | — | EP | claimed |
| WO-2009106441-A1 | PYRROLOPYRAZINE KINASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2009-09-03 | — | — | WO | claimed |
| EP-2245033-A1 | PYRROLOPYRAZINE KINASE INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2010-11-03 | — | — | EP | disclosed |
| WO-2009106441-A1 | PYRROLOPYRAZINE KINASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2009-09-03 | — | — | WO | disclosed |