Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | AKR1C3 | P42330 | 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 | |
|---|---|---|---|---|
| SCHEMBL11345727 | 0.80 | AKR1C3 (0.33) | AKR1C3 | |
| Propylene Glycol SCHEMBL5148435 | 0.75 | TDP1 (0.39) | — | |
| Propylene Glycol SCHEMBL2059788 | 0.75 | TDP1 (0.39) | — | |
| SCHEMBL27695407 | 0.73 | TP53 (0.32) | TP53PTGS1AKR1C3 | |
| SCHEMBL28095396 | 0.73 | TP53 (0.32) | TP53PTGS1AKR1C3 | |
| SCHEMBL14312469 | 0.72 | — | — | |
| SCHEMBL17353517 | 0.71 | PTGS1 (0.32) | PTGS1AKR1C3 | |
| SCHEMBL11345716 | 0.71 | — | — | |
| SCHEMBL11345712 | 0.71 | — | — | |
| SCHEMBL6264958 | 0.71 | TP53 (0.31) | TP53 |
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-1956368-A1 | Nano hybrid gels as polymer electrolytes | Hamilton Bonaduz AG (CH) | 2008-08-13 | — | — | EP | disclosed |