Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 4/20 | 0.52 |
| ▸ | SPHK1 | Q9NYA1 | 12/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | SPHK2 | Q9NRA0 | 7/20 | 0.33 |
| ▸ | LSS | P48449 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14473176 | 0.94 | ESR2 (0.57) | ESR2SPHK1ESR1CYP3A4CYP2C9 | |
| SCHEMBL17553420 | 0.89 | ESR2 (0.52) | ESR2SPHK1ESR1CYP3A4CYP2C9 | |
| SCHEMBL19401242 | 0.79 | ESR2 (0.57) | ESR2SPHK1ESR1CYP3A4CYP2C9 | |
| SCHEMBL9314978 | 0.78 | ESR2 (0.47) | ESR2SPHK1ESR1CYP3A4CYP2C9 | |
| SCHEMBL9314991 | 0.78 | ESR2 (0.47) | ESR2SPHK1ESR1CYP3A4CYP2C9 | |
| SCHEMBL9314982 | 0.78 | ESR2 (0.47) | ESR2SPHK1ESR1CYP3A4CYP2C9 | |
| SCHEMBL11196166 | 0.78 | ESR2 (0.77) | ESR2SPHK1ESR1CYP3A4CYP2C9 | |
| SCHEMBL17666384 | 0.77 | ESR2 (0.59) | ESR2CYP3A4CYP2C9 | |
| SCHEMBL16527200 | 0.77 | HDAC1 (0.41) | ESR2ESR1CYP3A4CYP2C9HRH3 | |
| SCHEMBL24554063 | 0.76 | ESR2 (0.45) | ESR2SPHK1SPHK2 |
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-9518221-B2 | Nematic liquid crystal composition and liquid crystal display device using the same | DIC CORPORATION (JP) | 2016-12-13 | — | — | US | disclosed |
| US-20150252262-A1 | NEMATIC LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE USING THE SAME | SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) | 2015-09-10 | — | — | US | disclosed |