Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.34 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.34 |
| ▸ | NAAA | Q02083 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | GCK | P35557 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CTSL | P07711 | 1/20 | 0.33 |
| ▸ | CTSS | P25774 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14767030 | 0.92 | NAAA (0.40) | PTGESCYP3A4PTGDRPTGDR2NAAA | |
| SCHEMBL12738911 | 0.88 | PTGS2 (0.34) | POLBS1PR1CTSLCTSSCTSK | |
| SCHEMBL14765756 | 0.87 | FFAR1 (0.38) | NAAAGABRA1GABRB2LMNAS1PR1 | |
| SCHEMBL12823624 | 0.85 | GRIN2B (0.32) | CYP3A4NAAAS1PR1CTSLCTSS | |
| SCHEMBL14766449 | 0.85 | S1PR1 (0.41) | PTGESGABRA1GABRB2S1PR1 | |
| SCHEMBL14766434 | 0.84 | S1PR1 (0.45) | PTGESS1PR1CYP17A1 | |
| SCHEMBL12735665 | 0.84 | FFAR4 (0.36) | GABRA1GABRB2LMNAS1PR1ALDH1A1 | |
| SCHEMBL14766747 | 0.83 | GABRA1 (0.34) | PTGESCYP3A4PTGDRPTGDR2GABRA1 | |
| SCHEMBL14766638 | 0.83 | S1PR1 (0.33) | NAAAGABRA1GABRB2S1PR1CYP17A1 | |
| SCHEMBL12738893 | 0.82 | BRD4 (0.38) | NAAAS1PR1CYP17A1FFAR4 |
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-8394294-B2 | Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device | JNC CORPORATION (JP) | 2013-03-12 | — | — | US | disclosed |