Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.32 |
| ▸ | ELANE | P08246 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | CASP7 | P55210 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 2/20 | 0.31 |
| ▸ | RARA | P10276 | 1/20 | 0.31 |
| ▸ | RARB | P10826 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL13863902 | 0.93 | RARB (0.36) | RARARARBCYP1A2CYP2D6CYP2C19 | |
| SCHEMBL13863807 | 0.93 | RARA (0.38) | ELANEHTTRARARARBCYP1A2 | |
| SCHEMBL13863876 | 0.90 | PLA2G2A (0.39) | RARARARB | |
| SCHEMBL91912 | 0.90 | PLA2G2A (0.39) | RARARARB | |
| SCHEMBL13863811 | 0.90 | PLA2G2A (0.39) | RARARARB | |
| SCHEMBL13863901 | 0.88 | L3MBTL1 (0.35) | FFAR1MAPTRARARARBCYP1A2 | |
| SCHEMBL13863873 | 0.88 | FFAR4 (0.32) | ELANEALDH1A1MAPTKDM4EMEN1 | |
| SCHEMBL91910 | 0.86 | ADORA3 (0.35) | ADORA3FFAR1ELANEALDH1A1MAPT | |
| SCHEMBL91837 | 0.85 | FFAR4 (0.39) | FFAR1ALDH1A1MAPTKDM4EMEN1 | |
| SCHEMBL91849 | 0.85 | FFAR1 (0.41) | FFAR1ELANE |
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-8129002-B2 | Compounds for use in liquid crystal media | MERCK PATENT GMBH (DE) | 2012-03-06 | — | — | US | disclosed |
| US-7531106-B2 | Mesogenic compounds, medium for electro-optical displays and electro-optical display | MERCK PATENT GMBH (DE) | 2009-05-12 | — | — | US | disclosed |