Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| 2,2,3-Trimethylbutane SCHEMBL1788862 | 0.87 | — | — | |
| 2,2,3-Trimethylbutane SCHEMBL11400965 | 0.87 | — | — | |
| 2,2,3-Trimethylbutane SCHEMBL11287489 | 0.82 | — | — | |
| 2,2,3-Trimethylbutane SCHEMBL27962450 | 0.82 | ALDH1A1 (0.36) | ALDH1A1TSHRHSD17B10 | |
| 2,2,3-Trimethylbutane SCHEMBL122284 | 0.82 | — | — | |
| 2,2,3-Trimethylbutane SCHEMBL4481319 | 0.82 | ALDH1A1 (0.44) | ALDH1A1TSHRHSD17B10 | |
| 2,2,3-Trimethylbutane SCHEMBL8037694 | 0.77 | — | — | |
| 2,2,3-Trimethylbutane SCHEMBL30565590 | 0.77 | — | — | |
| 2,2,3-Trimethylbutane SCHEMBL30369120 | 0.77 | — | — | |
| Ammonia Solution, Strong SCHEMBL28248647 | 0.77 | — | — |
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-103896785-A | Double-center quaternary ammonium salt ion liquid, preparation method thereof, electrolyte and lithium ion battery | OCEANS KING LIGHTING SCIENCE | 2014-07-02 | — | — | CN | disclosed |