Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 10/20 | 0.54 |
| ▸ | MAPK13 | O15264 | 8/20 | 0.54 |
| ▸ | MAPK12 | P53778 | 8/20 | 0.54 |
| ▸ | MAPK11 | Q15759 | 8/20 | 0.54 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.45 |
| ▸ | GCGR | P47871 | 6/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.43 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.41 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
| ▸ | LCK | P06239 | 1/20 | 0.41 |
| ▸ | RET | P07949 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | PRKACA | P17612 | 1/20 | 0.41 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.41 |
| ▸ | MATK | P42679 | 1/20 | 0.41 |
| ▸ | FRK | P42685 | 1/20 | 0.41 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.41 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.41 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.41 |
| ▸ | GSK3A | P49840 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8051549 | 0.76 | MAPK14 (0.46) | MAPK14MAPK13MAPK12MAPK11GCGR | |
| SCHEMBL7779945 | 0.76 | MAPK14 (0.46) | MAPK14MAPK13MAPK12MAPK11GCGR | |
| SCHEMBL7215030 | 0.73 | BRAF (0.51) | MAPK14MAPK13MAPK12MAPK11ADORA1 | |
| Ammonia Solution, Strong SCHEMBL28180214 | 0.73 | ADORA1 (0.51) | ADORA1 | |
| SCHEMBL9345348 | 0.70 | ADORA1 (0.50) | MAPK14MAPK13MAPK12MAPK11ADORA1 | |
| SCHEMBL26635167 | 0.69 | PDE4B (0.31) | — | |
| SCHEMBL30540186 | 0.69 | PDE4B (0.31) | — | |
| SCHEMBL2084081 | 0.69 | PTGS2 (0.42) | MAPK14MAPK13MAPK12MAPK11GCGR | |
| SCHEMBL7090769 | 0.69 | MAPK14 (0.61) | MAPK14MAPK13MAPK12MAPK11GCGR | |
| SCHEMBL7777792 | 0.69 | GYS1 (0.54) | MAPK14MAPK13MAPK12MAPK11GCGR |
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-0808305-A1 | 3,4-DIARYL SUBSTITUTED PYRIDINES FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1997-11-26 | — | — | EP | disclosed |
| WO-1996024585-A1 | 3,4-DIARYL SUBSTITUTED PYRIDINES FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1996-08-15 | — | — | WO | disclosed |