Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | DPP4 | P27487 | 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 | |
|---|---|---|---|---|
| SCHEMBL28823993 | 1.00 | ALDH1A1 (0.34) | ALDH1A1TP53ALOX15HTTPTK2B | |
| SCHEMBL12200032 | 0.76 | CYP1A2 (0.31) | — | |
| SCHEMBL2275997 | 0.76 | CYP1A2 (0.31) | — | |
| SCHEMBL2275993 | 0.76 | CYP1A2 (0.31) | — | |
| SCHEMBL28928422 | 0.74 | TP53 (0.33) | TP53 | |
| SCHEMBL23301101 | 0.72 | — | — | |
| SCHEMBL21857857 | 0.72 | — | — | |
| SCHEMBL28890358 | 0.72 | CYP1A2 (0.31) | — | |
| SCHEMBL20899842 | 0.70 | POLB (0.33) | — | |
| SCHEMBL20899843 | 0.70 | POLB (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-114957234-A | Triazole-containing phenyloxadiazole derivative and preparation method and application thereof | 浙江工业大学 | 2022-08-30 | — | — | CN | disclosed |