Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.42 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.42 |
| ▸ | PHF8 | Q9UPP1 | 1/20 | 0.42 |
| ▸ | KDM5A | P29375 | 1/20 | 0.41 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.35 |
| ▸ | GUCY1B2 | O75343 | 1/20 | 0.34 |
| ▸ | GUCY1A2 | P33402 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | GUCY1A1 | Q02108 | 1/20 | 0.34 |
| ▸ | GUCY1B1 | Q02153 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL14031727 | 0.77 | CYP2E1 (0.41) | CYP2C9CYP2C19CYP2E1CYP2A6CYP2B6 | |
| SCHEMBL16547507 | 0.75 | CYP2C9 (0.52) | CYP2C9CYP2C19CYP2E1CYP2A6CYP2B6 | |
| SCHEMBL24921816 | 0.73 | CYP2E1 (0.41) | CYP2C9CYP2C19CYP2E1CYP2A6CYP2B6 | |
| SCHEMBL27754726 | 0.72 | HSP90AA1 (0.42) | IRAK4KDM4EMEN1NOS3NOS1 | |
| SCHEMBL14844627 | 0.71 | LRRK2 (0.48) | CYP2C9CYP2C19CYP2E1CYP2A6CYP2B6 | |
| SCHEMBL23753887 | 0.71 | MTOR (0.43) | ADORA2ALRRK2IRAK4MKNK1MKNK2 | |
| SCHEMBL13729880 | 0.71 | CYP2E1 (0.39) | CYP2C9CYP2C19CYP2E1CYP2A6CYP2B6 | |
| SCHEMBL19381554 | 0.70 | GUCY1B2 (0.36) | IRAK4GUCY1B2GUCY1A2OPRK1GUCY1A1 | |
| SCHEMBL30884643 | 0.70 | ALDH1A1 (0.46) | MAPTIRAK4KDM4EMEN1NOS3 | |
| SCHEMBL29195175 | 0.70 | ALDH1A1 (0.46) | MAPTIRAK4KDM4EMEN1NOS3 |
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-2346859-A1 | HETEROCYCLIC JAK KINASE INHIBITORS | AstraZeneca AB (SE) | 2011-07-27 | — | — | EP | disclosed |