Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | ALOX5AP | P20292 | 4/20 | 0.33 |
| ▸ | FEN1 | P39748 | 4/20 | 0.33 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.33 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.33 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9019627 | 0.97 | CYP17A1 (0.33) | CYP17A1CYP3A4CYP11B1CYP11B2ALOX5AP | |
| SCHEMBL8934294 | 0.87 | DGAT1 (0.33) | DGAT1 | |
| SCHEMBL9019484 | 0.86 | ALOX5AP (0.34) | ALOX5APFEN1 | |
| SCHEMBL8961008 | 0.84 | DGAT1 (0.32) | DGAT1 | |
| SCHEMBL8934308 | 0.84 | DGAT1 (0.33) | DGAT1 | |
| SCHEMBL8934390 | 0.84 | TDP2 (0.35) | CYP17A1ALOX5APFEN1DGAT1 | |
| SCHEMBL15255941 | 0.84 | CYP17A1 (0.30) | CYP17A1CYP3A4CYP11B1CYP11B2 | |
| SCHEMBL15681399 | 0.83 | HDAC2 (0.36) | CYP3A4 | |
| SCHEMBL9013724 | 0.83 | CYP3A4 (0.38) | CYP3A4 | |
| SCHEMBL8934438 | 0.83 | NAAA (0.34) | ALOX5APFEN1DGAT1 |
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-8187494-B2 | Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device | JNC CORPORATION (JP) | 2012-05-29 | — | — | US | disclosed |
| EP-2206695-A1 | TETRA- OR PENTA-CYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT | Chisso Corporation (JP) | 2010-07-14 | — | — | EP | disclosed |