Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 20/20 | 0.69 |
| ▸ | MAPK13 | O15264 | 17/20 | 0.69 |
| ▸ | MAPK12 | P53778 | 17/20 | 0.69 |
| ▸ | MAPK11 | Q15759 | 17/20 | 0.69 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.69 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.69 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.69 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.69 |
| ▸ | HTR2C | P28335 | 1/20 | 0.69 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.69 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.69 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.59 |
| ▸ | GCGR | P47871 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL5618524 | 0.82 | MAPK14 (0.70) | MAPK14MAPK13MAPK12MAPK11CYP3A4 | |
| SCHEMBL8706893 | 0.82 | MAPK14 (1.00) | MAPK14MAPK13MAPK12MAPK11CYP3A4 | |
| SCHEMBL29628795 | 0.82 | MAPK14 (1.00) | MAPK14MAPK13MAPK12MAPK11CYP3A4 | |
| SCHEMBL149547 | 0.82 | MAPK14 (1.00) | MAPK14MAPK13MAPK12MAPK11CYP3A4 | |
| SCHEMBL8709974 | 0.78 | MAPK14 (1.00) | MAPK14MAPK13MAPK12MAPK11CYP3A4 | |
| SCHEMBL8705978 | 0.75 | MAPK14 (1.00) | MAPK14MAPK13MAPK12MAPK11CYP3A4 | |
| SCHEMBL6247693 | 0.74 | MAPK14 (1.00) | MAPK14MAPK13MAPK12MAPK11CYP3A4 | |
| SCHEMBL6640436 | 0.74 | MAPK14 (1.00) | MAPK14MAPK13MAPK12MAPK11CYP3A4 | |
| SCHEMBL6640822 | 0.70 | MAPK14 (0.69) | MAPK14MAPK13MAPK12MAPK11CYP3A4 | |
| SCHEMBL8705885 | 0.70 | MAPK14 (1.00) | MAPK14MAPK13MAPK12MAPK11CYP3A4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1313713-B1 | 4-PYRIMIDINAMINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND RELATED METHODS | ORTHO MCNEIL PHARM INC (US) | 2008-06-11 | — | — | EP | disclosed |