Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 8/20 | 0.43 |
| ▸ | S1PR3 | Q99500 | 4/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 5/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 5/20 | 0.38 |
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
| ▸ | RORC | P51449 | 1/20 | 0.37 |
| ▸ | AR | P10275 | 2/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.36 |
| ▸ | AKR1C1 | Q04828 | 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 | |
|---|---|---|---|---|
| SCHEMBL3845967 | 0.88 | GLA (0.42) | S1PR1S1PR3GLAPOLBGAA | |
| SCHEMBL3534403 | 0.83 | GLA (0.54) | GLAPOLBGAATSHRAKR1C3 | |
| SCHEMBL25011732 | 0.82 | GLA (0.45) | GLAPOLBGAATSHRAKR1C3 | |
| SCHEMBL27638533 | 0.80 | S1PR1 (0.52) | S1PR1S1PR3GLAPOLBGAA | |
| SCHEMBL4781603 | 0.78 | KIF11 (0.54) | S1PR1S1PR3TSHRKIF11SCN9A | |
| SCHEMBL17629903 | 0.78 | KIF11 (0.51) | KIF11AR | |
| SCHEMBL2942635 | 0.77 | S1PR1 (0.47) | S1PR1S1PR3GLAPOLBGAA | |
| SCHEMBL4664391 | 0.77 | S1PR1 (0.43) | S1PR1S1PR3GLAPOLBGAA | |
| SCHEMBL1802128 | 0.77 | ALOX5 (0.59) | S1PR1S1PR3KIF11AR | |
| SCHEMBL4637120 | 0.77 | AKR1C3 (0.51) | S1PR1S1PR3AKR1C3AKR1C2RORC |
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 |
|---|---|---|---|---|---|---|---|
| CN-113943287-B | Polycyclic aromatic compound and application thereof in electroluminescent device | 清华大学 | 2023-02-03 | — | — | CN | disclosed |