Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | LSS | P48449 | 2/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | NAAA | Q02083 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL8207822 | 1.00 | CYP1A2 (0.35) | CYP1A2HTTMEN1KMT2ATP53 | |
| SCHEMBL8207814 | 1.00 | CYP1A2 (0.35) | CYP1A2HTTMEN1KMT2ATP53 | |
| SCHEMBL7723557 | 1.00 | CYP1A2 (0.35) | CYP1A2HTTMEN1KMT2ATP53 | |
| SCHEMBL8216142 | 0.98 | CYP1A2 (0.36) | CYP1A2HTTMEN1KMT2ATP53 | |
| SCHEMBL7733136 | 0.98 | CYP1A2 (0.36) | CYP1A2HTTMEN1KMT2ATP53 | |
| SCHEMBL8216146 | 0.98 | CYP1A2 (0.36) | CYP1A2HTTMEN1KMT2ATP53 | |
| SCHEMBL7733133 | 0.98 | CYP1A2 (0.36) | CYP1A2HTTMEN1KMT2ATP53 | |
| SCHEMBL8208918 | 0.97 | CYP1A2 (0.33) | CYP1A2HTTMEN1KMT2ATP53 | |
| SCHEMBL7733128 | 0.97 | CYP1A2 (0.33) | CYP1A2HTTMEN1KMT2ATP53 | |
| SCHEMBL7733131 | 0.97 | CYP1A2 (0.33) | CYP1A2HTTMEN1KMT2ATP53 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0929508-B1 | LIQUID CRYSTALLINE (E,E)-BUTADIENE COMPOUNDS AND MIXTURES AND DEVICES CONTAINING SUCH COMPOUNDS | QINETIQ LTD (GB) | 2002-03-20 | — | — | EP | disclosed |
| US-6106908-A | OPTICAL APPARATUS WITH LIQUID CRYSTAL COMPOUNDS | THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) | 2000-08-22 | — | — | US | disclosed |