Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 5/20 | 0.45 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | RAPGEF4 | Q8WZA2 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL25844613 | 0.90 | AR (0.49) | ARCYP11B1CYP11B2ALDH1A1SMN1; SMN2 | |
| SCHEMBL1044722 | 0.79 | MEN1 (0.47) | ALDH1A1MEN1KMT2ARAPGEF4MAPT | |
| SCHEMBL18272233 | 0.76 | SMN1; SMN2 (0.40) | ARALDH1A1MEN1KMT2ARAPGEF4 | |
| SCHEMBL1133428 | 0.76 | MAPT (0.48) | RAPGEF4MAPT | |
| SCHEMBL5543801 | 0.75 | AR (0.35) | ARMEN1KMT2ARAPGEF4CYP1A2 | |
| SCHEMBL26373611 | 0.74 | AR (0.42) | ARCYP11B1CYP11B2ALDH1A1AKR1C3 | |
| SCHEMBL20108597 | 0.73 | MAPT (0.37) | ARCYP11B1CYP11B2MEN1KMT2A | |
| SCHEMBL17297890 | 0.72 | AR (0.61) | ARCYP11B1CYP11B2ALDH1A1AKR1C3 | |
| SCHEMBL19323000 | 0.72 | AKR1C3 (0.58) | ARCYP11B1CYP11B2ALDH1A1SMN1; SMN2 | |
| SCHEMBL26375504 | 0.72 | IKBKB (0.46) | ARRAPGEF4 |
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-2964635-B1 | ANTIVIRAL COMPOUNDS | HOFFMANN LA ROCHE (CH) | 2018-05-02 | — | — | EP | disclosed |