Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K14 | Q99558 | 11/20 | 0.40 |
| ▸ | GRM5 | P41594 | 3/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | PRKD1 | Q15139 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7478209 | 0.88 | MAP3K14 (0.41) | MAP3K14GRM5PRKD1ADORA2AADORA2B | |
| SCHEMBL7478407 | 0.81 | MAPK14 (0.39) | GRM5ALOX15MAPK14 | |
| SCHEMBL7482460 | 0.79 | MAPK14 (0.53) | ALOX15MAPK14 | |
| SCHEMBL7464576 | 0.77 | ALOX15 (0.47) | ALOX15MAPK14 | |
| SCHEMBL7474793 | 0.77 | ALOX15 (0.44) | ALOX15MAPK14 | |
| SCHEMBL7480688 | 0.75 | ALOX15 (0.43) | ALOX15MAPK14 | |
| SCHEMBL7473891 | 0.73 | MAPK14 (0.52) | ALOX15ADORA2AADORA2BADORA1ADORA3 | |
| SCHEMBL7475964 | 0.73 | CYP2D6 (0.47) | ALOX15 | |
| SCHEMBL6158445 | 0.73 | MAPK14 (0.58) | MAPK14 | |
| SCHEMBL7479297 | 0.72 | MAPK14 (0.54) | ALOX15MAPK14 |
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-1218346-A1 | PYRAZOLE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2002-07-03 | — | — | EP | disclosed |
| WO-2001021591-A1 | PYRAZOLE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2001-03-29 | — | — | WO | disclosed |
| EP-1075467-A1 | PYRAZOLE DERIVATIVES AS P-38 MAP KINASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2001-02-14 | — | — | EP | disclosed |
| WO-1999057101-A1 | PYRAZOLE DERIVATIVES AS P-38 MAP KINASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 1999-11-11 | — | — | WO | disclosed |