Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 8/20 | 0.39 |
| ▸ | KDM1A | O60341 | 2/20 | 0.37 |
| ▸ | CALM1 | P0DP23 | 2/20 | 0.36 |
| ▸ | DAO | P14920 | 1/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 3/20 | 0.35 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14766317 | 0.91 | KDM1A (0.37) | KDM1ACALM1HCRTR1HCRTR2 | |
| SCHEMBL12823731 | 0.91 | BACE1 (0.40) | BACE1DAO | |
| SCHEMBL12739711 | 0.91 | KDM1A (0.38) | KDM1ACALM1HCRTR1HCRTR2 | |
| SCHEMBL12739709 | 0.91 | KDM1A (0.38) | KDM1ACALM1HCRTR1HCRTR2 | |
| SCHEMBL10303097 | 0.90 | CALM1 (0.41) | CALM1 | |
| SCHEMBL12739722 | 0.90 | KDM1A (0.38) | KDM1ACALM1HCRTR1HCRTR2 | |
| SCHEMBL12739720 | 0.89 | KDM1A (0.37) | KDM1ACALM1HCRTR1HCRTR2 | |
| SCHEMBL12739714 | 0.88 | KDM1A (0.36) | KDM1ACALM1HCRTR1HCRTR2 | |
| SCHEMBL14766569 | 0.87 | KDM1A (0.34) | KDM1ACALM1HCRTR1HCRTR2 | |
| SCHEMBL12739715 | 0.86 | KDM1A (0.35) | BACE1KDM1ACALM1HCRTR1HCRTR2 |
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 |