Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2B6 | P20813 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | FDPS | P14324 | 1/20 | 0.33 |
| ▸ | AGER | Q15109 | 1/20 | 0.33 |
| ▸ | QPCT | Q16769 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | PDE8B | O95263 | 1/20 | 0.32 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.32 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9859453 | 0.88 | CYP2B6 (0.37) | CYP2B6CYP19A1FDPSAGERQPCT | |
| SCHEMBL25267240 | 0.73 | MEN1 (0.30) | — | |
| SCHEMBL25560709 | 0.73 | MEN1 (0.30) | — | |
| SCHEMBL14160738 | 0.73 | MEN1 (0.30) | — | |
| SCHEMBL201200 | 0.73 | CYP2B6 (0.36) | CYP2B6FDPSPDE8BTBXA2R | |
| SCHEMBL201199 | 0.73 | CYP2B6 (0.36) | CYP2B6FDPSPDE8BTBXA2R | |
| SCHEMBL27296854 | 0.72 | — | — | |
| SCHEMBL8295973 | 0.70 | CYP2B6 (0.43) | CYP2B6CYP19A1QPCTGAA | |
| SCHEMBL10572039 | 0.68 | CYP2B6 (0.39) | CYP2B6FDPSQPCTGAAPDE8B | |
| SCHEMBL6299741 | 0.68 | CYP19A1 (0.51) | CYP19A1FDPSAGERQPCT |
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-0421210-A2 | Triazole compounds, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1991-04-10 | — | — | EP | disclosed |