Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR4 | O95977 | 5/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.33 |
| ▸ | S1PR5 | Q9H228 | 5/20 | 0.33 |
| ▸ | NR1H4 | Q96RI1 | 4/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.31 |
| ▸ | MAP3K12 | Q12852 | 1/20 | 0.30 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18977638 | 0.86 | CHRNA7 (0.36) | CHRNA7 | |
| SCHEMBL18977640 | 0.84 | POLB (0.35) | NR1H4NR1I2CYP2C9CYP2C19 | |
| SCHEMBL16364885 | 0.80 | MAP4K4 (0.33) | S1PR4S1PR1S1PR3S1PR5NR1H4 | |
| SCHEMBL15479717 | 0.78 | HCRTR1 (0.38) | S1PR4S1PR1S1PR3S1PR5NR1H4 | |
| SCHEMBL18977643 | 0.71 | POLB (0.50) | S1PR1CYP2C9CYP2C19 | |
| SCHEMBL16364714 | 0.69 | MAP4K4 (0.37) | NR1H4NR1I2CYP2C9CYP2C19 | |
| SCHEMBL23439154 | 0.69 | HCRTR1 (0.36) | NR1H4 | |
| SCHEMBL15479741 | 0.67 | HCRTR1 (0.37) | NR1H4NR1I2CYP2C9CYP2C19 | |
| SCHEMBL18977432 | 0.66 | ALDH1A1 (0.36) | NR1H4 | |
| SCHEMBL16364833 | 0.65 | MIF (0.36) | CHRNA7 |
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-2703392-B1 | 5-MEMBERED RING AROMATIC HETEROCYCLIC DERIVATIVE HAVING NPY Y5 RECEPTOR ANTAGONISTIC ACTIVITY | SHIONOGI & CO (JP) | 2017-06-14 | — | — | EP | disclosed |