Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 6/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.57 |
| ▸ | CYP2C8 | P10632 | 5/20 | 0.57 |
| ▸ | CYP2B6 | P20813 | 5/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.57 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.55 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.55 |
| ▸ | HTR1A | P08908 | 5/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.53 |
| ▸ | LTA4H | P09960 | 3/20 | 0.53 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.53 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.53 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | BLM | P54132 | 1/20 | 0.49 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL13693265 | 0.89 | CYP3A4 (0.51) | CYP3A4CYP2C9CYP2C19CYP2C8CYP2B6 | |
| SCHEMBL1270315 | 0.87 | CYP3A4 (0.57) | CYP3A4CYP2C9CYP2C19CYP2C8CYP2B6 | |
| SCHEMBL13693266 | 0.86 | RXRA (0.60) | CYP3A4CYP2C9CYP2C19CYP2C8CYP2B6 | |
| Dihydroferulic Acid Methyl Ester SCHEMBL490876 | 0.83 | ALOX5 (0.77) | CYP3A4CYP2C9CYP2C19CYP2C8CYP2B6 | |
| SCHEMBL22493033 | 0.83 | CYP3A4 (0.67) | CYP3A4CYP2C9CYP2C19CYP2C8CYP2B6 | |
| SCHEMBL9680935 | 0.81 | RXRA (0.53) | CYP3A4CYP2C9CYP2C19CYP2C8CYP2B6 | |
| SCHEMBL27594037 | 0.81 | IAPP (0.51) | CYP3A4CYP2C9CYP2C19CYP2C8CYP2B6 | |
| SCHEMBL1099001 | 0.81 | APP (0.50) | CYP3A4CYP2C9CYP2C19CYP2C8CYP2B6 | |
| SCHEMBL3968480 | 0.80 | FFAR4 (0.55) | ALOX5OR51E2TRPV1ALDH1A1HPGD | |
| SCHEMBL7528179 | 0.80 | LMNA (0.62) | CYP1A2CYP2D6ALDH1A1 |
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-7589170-B1 | Synthesis of cyclic peptides | THE UNIVERSITY OF QUEENSLAND (AU) | 2009-09-15 | — | — | US | disclosed |