Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.65 |
| ▸ | LMNA | P02545 | 2/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.65 |
| ▸ | MEN1 | O00255 | 2/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.65 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.60 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | ADH1B | P00325 | 1/20 | 0.41 |
| ▸ | ADH1C | P00326 | 1/20 | 0.41 |
| ▸ | ADH1A | P07327 | 1/20 | 0.41 |
| ▸ | ADH4 | P08319 | 1/20 | 0.41 |
| ▸ | ADH7 | P40394 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 3/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Docosanol SCHEMBL8945651 | 0.97 | TSHR (0.68) | TSHRLMNAALDH1A1MEN1KMT2A | |
| Cetyl Alcohol SCHEMBL8359228 | 0.84 | TSHR (0.72) | TSHRLMNAALDH1A1MEN1KMT2A | |
| Cetyl Alcohol SCHEMBL27475899 | 0.84 | TSHR (0.72) | TSHRLMNAALDH1A1MEN1KMT2A | |
| Tridecan-1-Ol SCHEMBL5174044 | 0.84 | TSHR (0.72) | TSHRLMNAALDH1A1MEN1KMT2A | |
| 1-Hexanol SCHEMBL1047802 | 0.84 | TSHR (0.72) | TSHRLMNAALDH1A1MEN1KMT2A | |
| Octanol SCHEMBL28176901 | 0.84 | TSHR (0.72) | TSHRLMNAALDH1A1MEN1KMT2A | |
| Cetyl Alcohol SCHEMBL27479769 | 0.84 | TSHR (0.72) | TSHRLMNAALDH1A1MEN1KMT2A | |
| Tridecan-1-Ol SCHEMBL9863316 | 0.84 | TSHR (0.72) | TSHRLMNAALDH1A1MEN1KMT2A | |
| 1-Heptanol SCHEMBL9723548 | 0.84 | LMNA (0.93) | TSHRLMNAALDH1A1MEN1KMT2A | |
| Octanol SCHEMBL10716445 | 0.84 | LMNA (0.93) | TSHRLMNAALDH1A1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5523495-A | REACTING KETONE OR ALDEHYDE WITH A DIHALOPROPENE IN PRESENCE OF ZINC POWDER, WATER AND ACID YIELDS A HALOALLYLCARBINOL WHICH CAN BE DEHALOGENATED WITH A BASE, NONEXPLOSIVE | SUMITOMO CHEMICAL COMPANY LIMITED (JP) | 1996-06-04 | — | — | US | disclosed |