Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HMGCR | P04035 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.30 |
| ▸ | ADRA1A | P35348 | 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 | |
|---|---|---|---|---|
| Dimethylketone Cyanohydrin SCHEMBL22127954 | 0.94 | LMNA (0.35) | LMNAALDH1A1TDP1TSHR | |
| Dimethylketone Cyanohydrin SCHEMBL11460654 | 0.90 | FFAR3 (0.44) | ALDH1A1TDP1TSHRHMGCRCHRM1 | |
| Dimethylketone Cyanohydrin SCHEMBL5478951 | 0.87 | ALDH1A1 (0.44) | ALDH1A1TDP1TSHRHMGCRCHRM1 | |
| Dimethylketone Cyanohydrin SCHEMBL34145 | 0.86 | — | — | |
| Dimethylketone Cyanohydrin SCHEMBL29665840 | 0.86 | — | — | |
| Dimethylketone Cyanohydrin SCHEMBL27317753 | 0.86 | TDP1 (0.38) | ALDH1A1TDP1TSHR | |
| Dimethylketone Cyanohydrin SCHEMBL27982437 | 0.82 | — | — | |
| Dimethylketone Cyanohydrin SCHEMBL27743725 | 0.82 | — | — | |
| Dimethylketone Cyanohydrin SCHEMBL686933 | 0.81 | TDP1 (0.60) | LMNATDP1 | |
| Dimethylketone Cyanohydrin SCHEMBL27825354 | 0.80 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105377810-B | The manufacturing method and reaction unit of α-hydroxyisobutyric acid amide | 三菱瓦斯化学株式会社 | 2018-10-19 | — | — | CN | disclosed |
| WO-2005093010-A2 | CONVERTING PROPYLENE IN AN OXYGENATE-CONTAMINATED PROPYLENE STREAM TO NON-POLYMERIZATION DERIVATIVE PRODUCTS | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2005-10-06 | — | — | WO | disclosed |