Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 8/20 | 0.53 |
| ▸ | CNR1 | P21554 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MITF | O75030 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | NSD2 | O96028 | 1/20 | 0.40 |
| ▸ | PDE9A | O76083 | 1/20 | 0.40 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6465913 | 0.81 | AR (0.76) | ARALDH1A1SMN1; SMN2NSD2CYP2D6 | |
| SCHEMBL3081229 | 0.78 | AR (0.50) | ARALDH1A1NPC1NSD2CYP1A2 | |
| SCHEMBL3063842 | 0.74 | AR (0.48) | ARNSD2NPSR1CYP1A2CYP3A4 | |
| SCHEMBL27815896 | 0.74 | AR (0.46) | ARALDH1A1NPC1NSD2NPSR1 | |
| SCHEMBL27815970 | 0.73 | AR (0.45) | ARALDH1A1NPC1NSD2NPSR1 | |
| SCHEMBL6889022 | 0.73 | AR (0.68) | AR | |
| SCHEMBL6465994 | 0.71 | AR (0.79) | ARALDH1A1SMN1; SMN2NSD2KDM4E | |
| SCHEMBL3081387 | 0.70 | PTGDR2 (0.51) | ARCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL3081189 | 0.70 | AR (0.42) | ARALDH1A1NPSR1CYP1A2CYP3A4 | |
| SCHEMBL3079008 | 0.70 | AR (0.47) | ARALDH1A1SMN1; SMN2HTTNSD2 |
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-1466902-A1 | ANDROGEN RECEPTOR ANTAGONISTS | Takeda Chemical Industries, Ltd. (JP) | 2004-10-13 | — | — | EP | disclosed |