Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN3B | O60391 | 1/20 | 0.37 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.37 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.37 |
| ▸ | MET | P08581 | 13/20 | 0.35 |
| ▸ | KDR | P35968 | 11/20 | 0.35 |
| ▸ | MST1R | Q04912 | 5/20 | 0.34 |
| ▸ | DGAT1 | O75907 | 4/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | IGF1R | P08069 | 1/20 | 0.32 |
| ▸ | SRC | P12931 | 1/20 | 0.32 |
| ▸ | FLT4 | P35916 | 1/20 | 0.32 |
| ▸ | FLT3 | P36888 | 1/20 | 0.32 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.32 |
| ▸ | TEK | Q02763 | 1/20 | 0.32 |
| ▸ | KLKB1 | P03952 | 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 | |
|---|---|---|---|---|
| SCHEMBL14655324 | 0.92 | MET (0.36) | METKDRMST1RDGAT1 | |
| SCHEMBL14655557 | 0.90 | PTPN1 (0.34) | DGAT1KLKB1 | |
| SCHEMBL14656033 | 0.88 | SIRT2 (0.34) | DGAT1KLKB1 | |
| SCHEMBL2380151 | 0.86 | GRIN3B (0.37) | GRIN3BGRIN1GRIN2CMETKDR | |
| SCHEMBL2380160 | 0.86 | GRIN3B (0.37) | GRIN3BGRIN1GRIN2CMETKDR | |
| SCHEMBL2377956 | 0.80 | JAK1 (0.40) | — | |
| SCHEMBL14655278 | 0.80 | NEK2 (0.47) | KDREGFRIGF1RSRCFLT4 | |
| SCHEMBL14795118 | 0.80 | DGAT1 (0.34) | DGAT1KLKB1 | |
| SCHEMBL14655487 | 0.79 | DGAT1 (0.38) | DGAT1KLKB1 | |
| SCHEMBL14795236 | 0.77 | DGAT1 (0.33) | DGAT1KLKB1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8518945-B2 | Pyrrolopyrazine kinase inhibitors | HOFFMANN-LA ROCHE INC. (US) | 2013-08-27 | — | — | US | disclosed |
| EP-2550273-A2 | PYRROLOPYRAZINE KINASE INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2013-01-30 | — | — | EP | disclosed |