Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | P4HB | P07237 | 4/20 | 0.43 |
| ▸ | SMAD3 | P84022 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | STAT3 | P40763 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7709780 | 0.87 | CYP3A4 (0.72) | CYP1A2CYP3A4CYP2D6CYP2C9ALOX15 | |
| SCHEMBL11088971 | 0.82 | ALOX15 (0.44) | CYP1A2CYP3A4CYP2D6CYP2C9ALOX15 | |
| SCHEMBL11086745 | 0.81 | ALOX15 (0.45) | CYP1A2CYP3A4CYP2D6CYP2C9ALOX15 | |
| SCHEMBL11089475 | 0.80 | HPGD (0.42) | CYP1A2CYP3A4CYP2D6CYP2C9ALOX15 | |
| SCHEMBL11090694 | 0.80 | ALOX15 (0.41) | CYP1A2CYP3A4CYP2D6CYP2C9ALOX15 | |
| SCHEMBL15145035 | 0.79 | LMNA (0.51) | CYP1A2CYP3A4CYP2D6CYP2C9ALOX15 | |
| SCHEMBL11087697 | 0.78 | CYP3A4 (0.69) | CYP1A2CYP3A4CYP2D6CYP2C9ALOX15 | |
| SCHEMBL24598762 | 0.74 | CYP1A2 (0.63) | CYP1A2CYP3A4CYP2D6CYP2C9ALOX15 | |
| SCHEMBL11094276 | 0.73 | CYP3A4 (0.62) | CYP1A2CYP3A4CYP2D6CYP2C9ALOX15 | |
| SCHEMBL11091615 | 0.73 | CYP3A4 (0.62) | CYP1A2CYP3A4CYP2D6CYP2C9ALOX15 |
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-4482728-A | ANTIFERTILITY AGENTS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) | 1984-11-13 | — | — | US | disclosed |
| US-4357344-A | Polybutylbenzylphenols and benzyl-3,4-methylenedioxybenzenes in insect population control | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) | 1982-11-02 | — | — | US | disclosed |
| US-4342777-A | GROWTH INHIBITOR FOR MOSQUITO LARVAE | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) | 1982-08-03 | — | — | US | disclosed |