Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CCR2 | P41597 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | GNAI3 | P08754 | 4/20 | 0.33 |
| ▸ | GNAO1 | P09471 | 4/20 | 0.33 |
| ▸ | GNAI1 | P63096 | 4/20 | 0.33 |
| ▸ | LSS | P48449 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8218872 | 0.92 | HTT (0.40) | CYP1A2CYP2D6CYP2C9CYP2C19HTT | |
| SCHEMBL21321660 | 0.85 | HTT (0.41) | CYP1A2CYP2D6CYP2C9CYP2C19HTT | |
| SCHEMBL12154875 | 0.83 | HTT (0.45) | CYP1A2CYP2D6CYP2C9CYP2C19HTT | |
| SCHEMBL4836366 | 0.82 | — | — | |
| SCHEMBL19722267 | 0.81 | PKM (0.39) | CYP1A2CYP2D6CYP2C9CYP2C19HTT | |
| SCHEMBL8010815 | 0.81 | HTT (0.44) | CYP1A2CYP2D6CYP2C9CYP2C19HTT | |
| SCHEMBL8219166 | 0.81 | HTT (0.40) | CYP1A2CYP2D6CYP2C9CYP2C19HTT | |
| SCHEMBL7524665 | 0.81 | HTT (0.46) | CYP1A2CYP2D6CYP2C9CYP2C19HTT | |
| SCHEMBL10707112 | 0.80 | CYP1A2 (0.54) | CYP1A2CYP2D6CYP2C9CYP2C19HTT | |
| SCHEMBL10346757 | 0.80 | CYP1A2 (0.54) | CYP1A2CYP2D6CYP2C9CYP2C19HTT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6143198-A | SUITABLE FOR USE AS ELECTRO-OPTICAL DISPLAY MATERIALS; LIQUID CRYSTALLINE COMPOUND HAVING A LARGE ELASTIC CONSTANT RATIO, EXCELLENT COMPATIBILITY WITH OTHER LIQUID CRYSTALLINE COMPOUND, AND LOW TEMPERATURE CHEMICAL STABILITY | CHISSO CORPORATION (JP) | 2000-11-07 | — | — | US | disclosed |
| EP-0828700-A1 | LIQUID CRYSTALLINE COMPOUNDS HAVING EXO-METHYLENE SITE AND LIQUID CRYSTAL COMPOSITIONS COMPRISING THE SAME | CHISSO CORPORATION (JP) | 1998-03-18 | — | — | EP | disclosed |
| WO-1996037451-A1 | LIQUID CRYSTALLINE COMPOUNDS HAVING EXO-METHYLENE SITE AND LIQUID CRYSTAL COMPOSITIONS COMPRISING THE SAME | CHISSO CORPORATION (JP) | 1996-11-28 | — | — | WO | disclosed |