Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL29972 | 1.00 | — | — | |
| Methyl Alcohol SCHEMBL11644599 | 0.95 | — | — | |
| Methane SCHEMBL5786697 | 0.95 | — | — | |
| Ethylene SCHEMBL27362925 | 0.95 | — | — | |
| Fluoride SCHEMBL27416012 | 0.95 | — | — | |
| Ethane SCHEMBL3288242 | 0.95 | — | — | |
| SCHEMBL27511034 | 0.88 | HSD17B10 (0.50) | TDP1HSD17B10ALDH1A1 | |
| Isobutane SCHEMBL27520106 | 0.88 | HSD17B10 (0.50) | TDP1HSD17B10TSHR | |
| Ethylene Glycol SCHEMBL5364211 | 0.84 | HSD17B10 (0.47) | TDP1HSD17B10TSHR | |
| Butane SCHEMBL6911098 | 0.84 | TDP1 (0.47) | TDP1HSD17B10ALDH1A1TSHR |
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-1125934-A | Process for preparing phenethanol ethers | HOECHST CELANESE CORP (US) | 1996-07-03 | — | — | CN | disclosed |