Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 11/20 | 0.46 |
| ▸ | JAK3 | P52333 | 3/20 | 0.41 |
| ▸ | SYK | P43405 | 2/20 | 0.40 |
| ▸ | SGK1 | O00141 | 1/20 | 0.39 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | APAF1 | O14727 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | JAK2 | O60674 | 1/20 | 0.39 |
| ▸ | JAK1 | P23458 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 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 | |
|---|---|---|---|---|
| SCHEMBL3398013 | 0.83 | KIT (0.40) | MAPK1JAK3SYKCYP2C9JAK2 | |
| SCHEMBL3399171 | 0.83 | SYK (0.61) | MAPK1SYKCYP2C9MAPT | |
| SCHEMBL3395784 | 0.81 | SYK (0.64) | JAK3SYKCYP2C9JAK2JAK1 | |
| SCHEMBL3393026 | 0.79 | MAPK1 (0.46) | MAPK1JAK3SYKCYP2C9KDM4E | |
| SCHEMBL3399617 | 0.79 | JAK2 (0.34) | JAK3SYKCYP2C9KDM4EAPAF1 | |
| SCHEMBL3394526 | 0.79 | JAK3 (0.36) | MAPK1JAK3SYKCYP2C9JAK2 | |
| SCHEMBL18238830 | 0.78 | MAPK1 (0.45) | MAPK1JAK3SYKSGK1 | |
| SCHEMBL16949014 | 0.78 | MAPK1 (0.45) | MAPK1JAK3SYKSGK1 | |
| SCHEMBL2274537 | 0.75 | SYK (0.48) | MAPK1JAK3SYKSGK1CAMKK2 | |
| SCHEMBL16948870 | 0.74 | JAK3 (0.47) | MAPK1JAK3JAK2 |
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 2 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 | disclosed |
| WO-2009106441-A1 | PYRROLOPYRAZINE KINASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2009-09-03 | — | — | WO | disclosed |