Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.68 |
| ▸ | TSHR | P16473 | 1/20 | 0.68 |
| ▸ | RARB | P10826 | 5/20 | 0.68 |
| ▸ | PLA2G4B | P0C869 | 7/20 | 0.66 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.63 |
| ▸ | HTT | P42858 | 2/20 | 0.62 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | APEX1 | P27695 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL9711933 | 1.00 | TP53 (0.68) | TP53TSHRRARBPLA2G4BMAPK1 | |
| SCHEMBL8074101 | 0.94 | MAPK1 (0.67) | TP53TSHRRARBPLA2G4BMAPK1 | |
| SCHEMBL8436025 | 0.94 | MAPK1 (0.67) | TP53TSHRRARBPLA2G4BMAPK1 | |
| Hydrochloric Acid SCHEMBL9812242 | 0.93 | MAPK1 (0.65) | TP53TSHRRARBPLA2G4BMAPK1 | |
| Hydrochloric Acid SCHEMBL9812237 | 0.93 | MAPK1 (0.65) | TP53TSHRRARBPLA2G4BMAPK1 | |
| SCHEMBL23517058 | 0.92 | RARB (0.64) | TP53TSHRRARBPLA2G4BMAPK1 | |
| SCHEMBL10525662 | 0.90 | TP53 (0.70) | TP53TSHRRARBPLA2G4BMAPK1 | |
| SCHEMBL9869039 | 0.90 | TP53 (0.75) | TP53TSHRRARBPLA2G4BMAPK1 | |
| SCHEMBL21172247 | 0.89 | MAPK1 (0.73) | TP53TSHRRARBPLA2G4BMAPK1 | |
| SCHEMBL10417399 | 0.88 | TP53 (0.68) | TP53TSHRRARBPLA2G4BMAPK1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0247466-B1 | Liquid-crystal derivatives of phenyl benzoate | HOFFMANN LA ROCHE (CH) | 1993-11-24 | — | — | EP | disclosed |
| US-5082589-A | Liquid crystalline esters | HOFFMANN-LA ROCHE INC. (US) | 1992-01-21 | — | — | US | disclosed |
| US-4925278-A | Liquid crystalline esters | HOFFMANN-LA ROCHE INC. (US) | 1990-05-15 | — | — | US | disclosed |
| US-4830470-A | Liquid crystalline esters | HOFFMANN-LA ROCHE INC. (US) | 1989-05-16 | — | — | US | disclosed |
| EP-0247466-A2 | Liquid-crystal derivatives of phenyl benzoate | F. HOFFMANN-LA ROCHE AG (CH) | 1987-12-02 | — | — | EP | disclosed |