Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR7 | Q9NYK1 | 3/20 | 0.33 |
| ▸ | CCR2 | P41597 | 2/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | DRD4 | P21917 | 1/20 | 0.31 |
| ▸ | DRD3 | P35462 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19423858 | 0.89 | CCR5 (0.31) | TLR7CCR2 | |
| SCHEMBL14944658 | 0.87 | TLR7 (0.36) | TLR7 | |
| SCHEMBL14944653 | 0.80 | DRD2 (0.31) | DRD2DRD4DRD3 | |
| SCHEMBL14944729 | 0.76 | ALDH1A1 (0.32) | TLR7 | |
| SCHEMBL14944654 | 0.74 | TLR7 (0.60) | TLR7 | |
| SCHEMBL20343752 | 0.73 | ADORA2A (0.39) | TLR7 | |
| SCHEMBL14944692 | 0.72 | TLR7 (0.38) | TLR7 | |
| SCHEMBL28852897 | 0.71 | HSP90AA1 (0.40) | TLR7 | |
| SCHEMBL14944686 | 0.70 | TLR7 (0.33) | TLR7 | |
| SCHEMBL14944688 | 0.68 | ALDH1A1 (0.30) | — |
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-2013068438-A1 | PURINE DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS | JANSSEN R&D IRELAND (IE) | 2013-05-16 | — | — | WO | disclosed |