Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL13664822 | 0.73 | CYP19A1 (0.34) | CYP19A1 | |
| SCHEMBL13664740 | 0.67 | — | — | |
| SCHEMBL511549 | 0.63 | CYP19A1 (0.38) | SLC6A2SLC6A4SLC6A3CYP19A1 | |
| SCHEMBL1617559 | 0.61 | TLR4 (0.42) | CYP19A1 | |
| SCHEMBL17080101 | 0.58 | PDE4A (0.41) | CYP19A1 | |
| SCHEMBL512155 | 0.56 | CYP19A1 (0.42) | CYP19A1 | |
| SCHEMBL1617268 | 0.56 | CYP19A1 (0.36) | CYP19A1 | |
| SCHEMBL10153102 | 0.55 | TDP1 (0.33) | — | |
| SCHEMBL25183474 | 0.55 | PDE4A (0.41) | CYP19A1 | |
| SCHEMBL18589007 | 0.55 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009119528-A1 | HETEROCYCLIC COMPOUND | 武田薬品工業株式会社 (JP) | 2009-10-01 | — | — | WO | disclosed |