Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| Butadiene SCHEMBL28152965 | 0.92 | TDP1 (0.65) | TDP1ALDH1A1TP53TSHR | |
| Butadiene SCHEMBL2133137 | 0.91 | — | — | |
| Propene SCHEMBL28139792 | 0.85 | — | — | |
| Acrylonitrile SCHEMBL11808927 | 0.83 | TDP1 (0.61) | TDP1ALDH1A1TP53TSHR | |
| Butadiene SCHEMBL27568645 | 0.83 | TDP1 (0.61) | TDP1ALDH1A1TP53TSHR | |
| Propene SCHEMBL27443316 | 0.82 | TDP1 (0.69) | TDP1ALDH1A1TP53TSHR | |
| SCHEMBL28215697 | 0.79 | — | — | |
| Butadiene SCHEMBL11805947 | 0.79 | TDP1 (0.55) | TDP1ALDH1A1TP53TSHR | |
| SCHEMBL14868 | 0.78 | — | — | |
| SCHEMBL9859678 | 0.78 | TDP1 (1.00) | TDP1ALDH1A1TP53TSHR |
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-109689711-A | Composition | 电化株式会社 | 2019-04-26 | — | — | CN | disclosed |