Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 7/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.49 |
| ▸ | NQO2 | P16083 | 2/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.40 |
| ▸ | MINK1 | Q8N4C8 | 2/20 | 0.40 |
| ▸ | TNIK | Q9UKE5 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.38 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.38 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.38 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.38 |
| ▸ | SYK | P43405 | 1/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | PDE2A | O00408 | 1/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1462836 | 0.87 | ADORA2B (0.48) | ADORA2BADORA2ANQO2MAPK14MAPK13 | |
| SCHEMBL12465997 | 0.74 | ADORA2B (0.48) | ADORA2BADORA2ANQO2IDO1MAP4K4 | |
| SCHEMBL22068158 | 0.73 | IDO1 (0.55) | ADORA2BADORA2AIDO1MAP4K4MINK1 | |
| SCHEMBL20012012 | 0.73 | IDO1 (0.45) | ADORA2BADORA2ANQO2IDO1MAP4K4 | |
| SCHEMBL30062513 | 0.73 | IDO1 (0.45) | ADORA2BADORA2ANQO2IDO1MAP4K4 | |
| SCHEMBL30427602 | 0.73 | ADORA2B (0.48) | ADORA2BADORA2ANQO2IDO1MAP4K4 | |
| SCHEMBL18161083 | 0.71 | IDO1 (0.46) | ADORA2BADORA2ANQO2IDO1MAP4K4 | |
| SCHEMBL15229110 | 0.70 | ADORA2B (0.44) | ADORA2BADORA2ANQO2IDO1MAP4K4 | |
| SCHEMBL26030813 | 0.70 | IDO1 (0.53) | ADORA2BADORA2AIDO1MAP4K4MINK1 | |
| SCHEMBL4060221 | 0.69 | MAP4K4 (0.46) | ADORA2BADORA2AIDO1MAP4K4MINK1 |
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-2459535-A1 | PYRIDINE AND PYRAZINE DERIVATIVES AS PROTEIN KINASE MODULATORS | Novartis AG (CH) | 2012-06-06 | — | — | EP | disclosed |
| WO-2011012661-A1 | PYRIDINE AND PYRAZINE DERIVATIVES AS PROTEIN KINASE MODULATORS | NOVARTIS AG (CH) | 2011-02-03 | — | — | WO | disclosed |