Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TK1 | P04183 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL8425862 | 0.90 | TK1 (0.34) | TK1ALDH1A1NPSR1 | |
| SCHEMBL9548787 | 0.85 | DUT (0.31) | — | |
| SCHEMBL9548703 | 0.84 | TK1 (0.36) | TK1ALDH1A1NPSR1 | |
| SCHEMBL9548831 | 0.84 | ALDH1A1 (0.36) | TK1ALDH1A1NPSR1 | |
| SCHEMBL9548645 | 0.81 | TK1 (0.34) | TK1ALDH1A1NPSR1 | |
| SCHEMBL9548862 | 0.78 | TK1 (0.32) | TK1ALDH1A1NPSR1 | |
| SCHEMBL9548667 | 0.78 | ADORA3 (0.39) | TK1ALDH1A1 | |
| SCHEMBL9548697 | 0.77 | PDE4D (0.31) | — | |
| SCHEMBL9548654 | 0.75 | DUT (0.31) | — | |
| SCHEMBL9548878 | 0.73 | ALDH1A1 (0.31) | TK1ALDH1A1NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5192749-A | Viricide, AIDS | SYNTEX (U.S.A.) INC. (US) | 1993-03-09 | — | — | US | disclosed |