Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.30 |
| ▸ | PTAFR | P25105 | 1/20 | 0.30 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | DRD4 | P21917 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30135283 | 0.68 | CYP2A6 (0.38) | PTAFR | |
| SCHEMBL7168168 | 0.67 | CHRNB4 (0.38) | NISCH | |
| SCHEMBL30502984 | 0.66 | PTGS2 (0.34) | DRD2DRD4 | |
| SCHEMBL710125 | 0.66 | PTGS2 (0.34) | DRD2DRD4 | |
| SCHEMBL6137530 | 0.66 | L3MBTL1 (0.37) | DRD2DRD4 | |
| SCHEMBL13984050 | 0.65 | — | — | |
| SCHEMBL1899000 | 0.64 | ABCG2 (0.31) | — | |
| SCHEMBL29372537 | 0.64 | ABCG2 (0.31) | — | |
| SCHEMBL3932147 | 0.64 | PTGS2 (0.30) | — | |
| SCHEMBL19664009 | 0.64 | PTGS2 (0.37) | DRD2DRD4 |
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-0539209-A1 | Benzo-isoquinoline derivatives and analogs and their use in therapeutics | THE UPJOHN COMPANY (US) | 1993-04-28 | — | — | EP | disclosed |