Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10399369 | 0.88 | ALDH1A1 (0.46) | ALDH1A1ALOX15RAB9APKMUSP2 | |
| SCHEMBL22711081 | 0.81 | ALDH1A1 (0.39) | ALDH1A1ALOX15RAB9APKMUSP2 | |
| SCHEMBL2302605 | 0.80 | ALDH1A1 (0.39) | ALDH1A1ALOX15RAB9APKMKMT2A | |
| SCHEMBL19277217 | 0.80 | ALDH1A1 (0.47) | ALDH1A1ALOX15RAB9APKMGAA | |
| SCHEMBL13084176 | 0.78 | CXCR3 (0.40) | ALDH1A1ALOX15RAB9APKMKMT2A | |
| SCHEMBL68781 | 0.77 | — | — | |
| SCHEMBL8087908 | 0.76 | ALDH1A1 (0.40) | ALDH1A1ALOX15RAB9APKMKMT2A | |
| SCHEMBL11316275 | 0.75 | ALDH1A1 (0.50) | ALDH1A1ALOX15RAB9APKMKMT2A | |
| SCHEMBL7991190 | 0.75 | ALDH1A1 (0.50) | ALDH1A1ALOX15RAB9APKMKMT2A | |
| SCHEMBL6053593 | 0.75 | ALDH1A1 (0.50) | ALDH1A1ALOX15RAB9APKMKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0549618-A1 | METHOD FOR THE PREPARATION OF TRANS-3,3,5-TRIMETHYLCYCLOHEXYL ETHYL ETHER. | HENKEL KGAA (DE) | 1993-07-07 | — | — | EP | disclosed |
| WO-1992005136-A1 | METHOD FOR THE PREPARATION OF TRANS-3,3,5-TRIMETHYLCYCLOHEXYL ETHYL ETHER | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 1992-04-02 | — | — | WO | disclosed |