Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 8/20 | 0.67 |
| ▸ | PDE9A | O76083 | 1/20 | 0.45 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.40 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | 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 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL6469486 | 0.83 | AR (0.56) | ARCYP11B1CYP11B2CYP19A1PTGDR2 | |
| SCHEMBL6889022 | 0.81 | AR (0.68) | ARCYP11B1CYP11B2CYP19A1PTGDR2 | |
| SCHEMBL6466939 | 0.76 | AR (0.67) | ARPTGDR2SMN1; SMN2LMNA | |
| SCHEMBL6468889 | 0.76 | AR (0.86) | ARPDE9APDE1CALDH1A1CYP11B1 | |
| SCHEMBL6469698 | 0.75 | AR (0.61) | ARKDM4EPTGDR2LMNA | |
| SCHEMBL24414502 | 0.75 | AR (0.80) | ARPDE9APDE1CALDH1A1CYP11B1 | |
| SCHEMBL6466328 | 0.73 | AR (0.57) | ARALDH1A1CYP11B1CYP11B2KDM4E | |
| SCHEMBL6466315 | 0.72 | AR (0.59) | ARALDH1A1CYP11B1CYP11B2CYP19A1 | |
| SCHEMBL6468911 | 0.71 | AR (1.00) | ARALDH1A1PKMSMN1; SMN2LMNA | |
| SCHEMBL6466727 | 0.71 | AR (0.60) | ARALDH1A1CYP11B1CYP11B2KDM4E |
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 |