Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL576290 | 0.91 | ALDH1A1 (0.36) | TDP1ALDH1A1TSHR | |
| SCHEMBL13174216 | 0.77 | — | — | |
| Dimethylketone Cyanohydrin SCHEMBL27743725 | 0.75 | — | — | |
| SCHEMBL6722950 | 0.75 | — | — | |
| SCHEMBL21224264 | 0.70 | TSHR (0.32) | TDP1ALDH1A1TSHR | |
| Dimethylketone Cyanohydrin SCHEMBL34145 | 0.70 | — | — | |
| SCHEMBL6138482 | 0.70 | — | — | |
| Dimethylketone Cyanohydrin SCHEMBL27317753 | 0.70 | TDP1 (0.38) | TDP1ALDH1A1TSHR | |
| Dimethylketone Cyanohydrin SCHEMBL29665840 | 0.70 | — | — | |
| SCHEMBL1057067 | 0.69 | — | — |
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-102539552-B | Method for detecting tetramethyl succinonitrile and application thereof | CHINA NAT BLUESTAR GROUP CO | 2014-06-18 | — | — | CN | disclosed |