Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 7/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 7/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 6/20 | 0.41 |
| ▸ | CNR2 | P34972 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | PPARD | Q03181 | 1/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
| ▸ | MGAM | O43451 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | SI | P14410 | 1/20 | 0.34 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.34 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.34 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL13224766 | 0.85 | ALDH1A1 (0.49) | ALDH1A1MAOBCYP3A4 | |
| SCHEMBL13394234 | 0.84 | ALOX5 (0.34) | GABRA1GABRB2ALOX5CNR2ALDH1A1 | |
| SCHEMBL15119647 | 0.80 | GABRA1 (0.47) | GABRA1GABRB2ALOX5MAOBPDCD1 | |
| SCHEMBL17193130 | 0.80 | GABRA1 (0.41) | GABRA1GABRB2ALOX5CNR2ALDH1A1 | |
| SCHEMBL15119653 | 0.78 | HSD11B1 (0.41) | GABRA1GABRB2ALOX5CNR2PPARG | |
| SCHEMBL13394230 | 0.77 | TRPA1 (0.41) | GABRA1GABRB2ALOX5CNR2ALDH1A1 | |
| SCHEMBL15119642 | 0.77 | TUBB1 (0.42) | GABRA1GABRB2ALOX5PDCD1CD274 | |
| SCHEMBL15119658 | 0.77 | RARB (0.46) | ALDH1A1PPARGPPARAPTGS1CYP3A4 | |
| SCHEMBL17847909 | 0.75 | MAOB (0.59) | ALDH1A1MAOBCYP3A4 | |
| SCHEMBL8854472 | 0.74 | HRH3 (0.41) | ALDH1A1MAOBCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-8361568-B2 | Liquid-crystalline medium | MERCK PATENT GMBH (DE) | 2013-01-29 | — | — | US | disclosed |
| US-20100102275-A1 | LIQUID-CRYSTALLINE MEDIUM | KLASEN-MEMMER MELANIE | 2010-04-29 | — | — | US | disclosed |