Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | PAM | P19021 | 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 | |
|---|---|---|---|---|
| SCHEMBL633425 | 0.87 | — | — | |
| SCHEMBL5176784 | 0.87 | — | — | |
| Acrylonitrile SCHEMBL2578377 | 0.78 | ALDH1A1 (0.45) | ALDH1A1CYP2D6ALOX15TSHR | |
| SCHEMBL27912109 | 0.78 | ALDH1A1 (0.52) | ALDH1A1CYP2D6ALOX15PAM | |
| SCHEMBL2698550 | 0.78 | ALDH1A1 (0.52) | ALDH1A1CYP2D6ALOX15PAM | |
| SCHEMBL17950790 | 0.78 | ALDH1A1 (0.52) | ALDH1A1CYP2D6ALOX15PAM | |
| SCHEMBL17540715 | 0.78 | ALDH1A1 (0.52) | ALDH1A1CYP2D6ALOX15PAM | |
| SCHEMBL2698556 | 0.78 | ALDH1A1 (0.52) | ALDH1A1CYP2D6ALOX15PAM | |
| SCHEMBL17540714 | 0.78 | ALDH1A1 (0.52) | ALDH1A1CYP2D6ALOX15PAM | |
| SCHEMBL28963153 | 0.74 | ALDH1A1 (0.55) | ALDH1A1CYP2D6ALOX15PAM |
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-107778564-A | A kind of nitrile rubber is ageing-resistant material modified and preparation method thereof | 四川力智久创知识产权运营有限公司 | 2018-03-09 | — | — | CN | disclosed |