Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K1 | Q92918 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | SYK | P43405 | 3/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 7/20 | 0.32 |
| ▸ | ABL1 | P00519 | 3/20 | 0.32 |
| ▸ | NTRK1 | P04629 | 3/20 | 0.32 |
| ▸ | YES1 | P07947 | 3/20 | 0.32 |
| ▸ | PIM1 | P11309 | 3/20 | 0.32 |
| ▸ | KDR | P35968 | 3/20 | 0.32 |
| ▸ | HIPK1 | Q86Z02 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 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 | 0.93 | MAP4K1 (0.40) | MAP4K1MAPTALDH1A1HSD17B10SYK | |
| SCHEMBL3398989 | 0.91 | MAP4K1 (0.38) | MAP4K1SYKKCNH2CYP2C9MAPK1 | |
| SCHEMBL3395900 | 0.91 | MAP4K1 (0.35) | MAP4K1KMT2AMAPTALDH1A1ALOX15 | |
| SCHEMBL3399615 | 0.90 | MAP4K1 (0.35) | MAP4K1SYKKCNH2CYP2C9MAPK1 | |
| SCHEMBL3395780 | 0.88 | MAP4K1 (0.34) | MAP4K1SYKKCNH2CYP2D6 | |
| SCHEMBL3396851 | 0.88 | SYK (0.36) | MAP4K1SYKKCNH2CYP2D6 | |
| SCHEMBL3398570 | 0.88 | SYK (0.35) | MAP4K1SYKKCNH2CYP2C9MAPK1 | |
| SCHEMBL3397319 | 0.85 | MAP4K1 (0.39) | MAP4K1ALDH1A1SYKCYP2C9MAPK1 | |
| SCHEMBL3396231 | 0.85 | BTK (0.33) | MAP4K1SYKKCNH2CYP2C9JAK3 | |
| SCHEMBL3396369 | 0.84 | 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 |