Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 3/20 | 0.48 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | THRA | P10827 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.41 |
| ▸ | FAAH | O00519 | 3/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9958054 | 0.90 | PDE10A (0.43) | LTA4HTP53CYP2D6CYP19A1CYP2C9 | |
| SCHEMBL5551744 | 0.77 | ACHE (0.47) | CYP3A4 | |
| Boric Acid SCHEMBL30378365 | 0.76 | LTA4H (0.64) | RARBNR5A1LTA4HTP53TSHR | |
| SCHEMBL29658410 | 0.76 | NR5A1 (0.65) | RARBNR5A1LTA4HTP53TSHR | |
| SCHEMBL6399200 | 0.76 | NR5A1 (0.65) | RARBNR5A1LTA4HTP53TSHR | |
| SCHEMBL9152810 | 0.74 | LTA4H (0.70) | RARBNR5A1LTA4HTP53TSHR | |
| SCHEMBL9153300 | 0.74 | LTA4H (0.70) | RARBNR5A1LTA4HTP53TSHR | |
| SCHEMBL9151222 | 0.74 | LTA4H (0.70) | RARBNR5A1LTA4HTP53TSHR | |
| SCHEMBL9153960 | 0.74 | LTA4H (0.70) | RARBNR5A1LTA4HTP53TSHR | |
| SCHEMBL2779495 | 0.74 | LTA4H (0.70) | RARBNR5A1LTA4HTP53TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-1221434-B1 | HYDROCARBON COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT AND ORGANIC ELECTROLUMINESCENT ELEMENT | MITSUI CHEMICALS INC (JP) | 2012-06-27 | — | — | EP | disclosed |