Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 2/20 | 0.63 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.47 |
| ▸ | MKNK1 | Q9BUB5 | 3/20 | 0.44 |
| ▸ | MKNK2 | Q9HBH9 | 3/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | JAK2 | O60674 | 2/20 | 0.42 |
| ▸ | JAK3 | P52333 | 1/20 | 0.42 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.42 |
| ▸ | RXRA | P19793 | 1/20 | 0.41 |
| ▸ | RXRB | P28702 | 1/20 | 0.41 |
| ▸ | RXRG | P48443 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.40 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9379977 | 0.91 | ROCK1 (0.61) | ROCK1MKNK1MKNK2SMN1; SMN2MAPK8 | |
| SCHEMBL28609745 | 0.89 | ROCK1 (0.60) | ROCK1MKNK1MKNK2SMN1; SMN2MAPK8 | |
| SCHEMBL18012073 | 0.83 | ROCK1 (0.64) | ROCK1NUDT1L3MBTL1JAK2JAK3 | |
| SCHEMBL5245431 | 0.79 | ROCK1 (0.63) | ROCK1NUDT1L3MBTL1JAK2JAK3 | |
| SCHEMBL16071242 | 0.78 | ROCK1 (0.58) | ROCK1NUDT1L3MBTL1JAK2JAK3 | |
| SCHEMBL12968733 | 0.78 | ROCK1 (1.00) | ROCK1NUDT1MKNK1MKNK2MAPK8 | |
| SCHEMBL28667775 | 0.77 | ROCK1 (0.53) | ROCK1NUDT1L3MBTL1JAK2JAK3 | |
| SCHEMBL30362762 | 0.77 | ROCK1 (0.53) | ROCK1NUDT1L3MBTL1JAK2JAK3 | |
| SCHEMBL6761496 | 0.77 | ROCK1 (0.72) | ROCK1NUDT1MKNK1MKNK2L3MBTL1 | |
| SCHEMBL17033290 | 0.75 | ROCK1 (0.62) | ROCK1NUDT1L3MBTL1JAK2JAK3 |
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-0901474-A1 | ARYL PYRIMIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 1999-03-17 | — | — | EP | disclosed |
| WO-1997044326-A1 | ARYL PYRIMIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 1997-11-27 | — | — | WO | disclosed |