Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.40 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.40 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.40 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.40 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.40 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.40 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.40 |
| ▸ | CYP2F1 | P24903 | 1/20 | 0.40 |
| ▸ | CYP2C18 | P33260 | 1/20 | 0.40 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.40 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.40 |
| ▸ | CYP4F8 | P98187 | 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 | |
|---|---|---|---|---|
| SCHEMBL27652302 | 0.90 | LTA4H (0.47) | CYP1A2CYP2C9CYP2C19CYP1A1CYP2E1 | |
| SCHEMBL6777000 | 0.88 | CYP1A1 (0.41) | ARCYP1A2CYP2C9CYP2C19CYP1A1 | |
| SCHEMBL6096838 | 0.82 | LTA4H (0.47) | CYP1A2CYP2C9CYP2C19CYP1A1CYP2E1 | |
| SCHEMBL27272353 | 0.81 | LTA4H (0.50) | CYP1A2CYP2C9CYP2C19POLBGAA | |
| SCHEMBL9775712 | 0.79 | AR (0.44) | ARCYP1A2CYP2C9CYP2C19POLB | |
| SCHEMBL733149 | 0.78 | CYP1A1 (0.56) | CYP1A2CYP2C9CYP2C19CYP1A1CYP2E1 | |
| SCHEMBL7017887 | 0.78 | CYP1A2 (0.39) | CYP1A2CYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL3536486 | 0.75 | CYP1A1 (0.44) | CYP1A2CYP2C9CYP2C19CYP1A1CYP2E1 | |
| SCHEMBL8129827 | 0.74 | NCOA1 (0.47) | ARCYP1A2CYP2C9CYP2C19GAA | |
| SCHEMBL2321472 | 0.74 | ALDH1A1 (0.61) | ARCYP1A2CYP2C9CYP2C19POLB |
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-5002957-A | Insecticides, acaricides, nematocides | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-03-26 | — | — | US | disclosed |