Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.55 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | PPARG | P37231 | 1/20 | 0.49 |
| ▸ | PPARD | Q03181 | 1/20 | 0.49 |
| ▸ | PPARA | Q07869 | 1/20 | 0.49 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.46 |
| ▸ | TUBB | P07437 | 1/20 | 0.46 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.46 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.46 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.46 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.46 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL10729189 | 0.85 | GABRA1 (0.65) | GABRA1GABRB2ALDH1A1HTTCYP3A4 | |
| SCHEMBL7075743 | 0.82 | ALDH1A1 (0.63) | GABRA1GABRB2ALDH1A1HTTCYP3A4 | |
| SCHEMBL68542 | 0.82 | ALDH1A1 (0.63) | GABRA1GABRB2ALDH1A1HTTCYP3A4 | |
| SCHEMBL13000171 | 0.81 | TUBB4A (0.47) | ALDH1A1HTTCYP3A4TUBB4ATUBB | |
| SCHEMBL31005006 | 0.80 | ALDH1A1 (0.61) | GABRA1GABRB2ALDH1A1HTTCYP3A4 | |
| Fluoride SCHEMBL28006168 | 0.80 | ALDH1A1 (0.61) | GABRA1GABRB2ALDH1A1HTTCYP3A4 | |
| SCHEMBL13000195 | 0.80 | TTR (0.53) | ALDH1A1HTTTUBB4ATUBBTUBA3C | |
| SCHEMBL17655660 | 0.77 | TNKS (0.59) | GABRA1GABRB2ALDH1A1HTTCYP3A4 | |
| SCHEMBL11553231 | 0.76 | ALDH1A1 (0.53) | ALDH1A1CYP3A4PPARGPPARDPPARA | |
| SCHEMBL15514315 | 0.76 | TUBB4A (0.60) | ALDH1A1CYP3A4TUBB4ATUBBTUBA3C |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0101223-B1 | PROCESS FOR PRODUCING PHENYLACETONES | UBE INDUSTRIES, LTD. (JP) | 1987-04-01 | — | — | EP | disclosed |
| US-4638094-A | OXIDATION OF PROPYLENEBENZENES | UBE INDUSTRIES, LTD. (JP) | 1987-01-20 | — | — | US | disclosed |
| EP-0101223-A2 | Process for producing phenylacetones | UBE INDUSTRIES, LTD. (JP) | 1984-02-22 | — | — | EP | disclosed |