Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 5/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.37 |
| ▸ | DHPS | P49366 | 3/20 | 0.36 |
| ▸ | GBA1 | P04062 | 2/20 | 0.35 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | CFTR | P13569 | 3/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14944658 | 0.76 | TLR7 (0.36) | ADORA2AADORA3ADORA1TLR7MAPK1 | |
| SCHEMBL28852897 | 0.75 | HSP90AA1 (0.40) | TLR7LMNA | |
| SCHEMBL14944653 | 0.74 | DRD2 (0.31) | ADORA2AADORA3MAPK1 | |
| SCHEMBL14944729 | 0.74 | ALDH1A1 (0.32) | ADORA2AADORA3TLR7 | |
| SCHEMBL14944685 | 0.73 | TLR7 (0.33) | TLR7 | |
| SCHEMBL14944688 | 0.72 | ALDH1A1 (0.30) | — | |
| SCHEMBL19423858 | 0.71 | CCR5 (0.31) | TLR7 | |
| SCHEMBL4144591 | 0.69 | HPRT1 (0.50) | — | |
| SCHEMBL28184098 | 0.69 | MAPK1 (0.39) | TLR7MAPK1 | |
| SCHEMBL28183208 | 0.69 | ABCB1 (0.38) | TLR7LMNA |
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-2776439-B1 | PURINE DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS | JANSSEN SCIENCES IRELAND UC (IE) | 2018-07-04 | — | — | EP | disclosed |