Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 7/20 | 0.72 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.48 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.42 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6468889 | 0.91 | AR (0.86) | ARALDH1A1KDM4ECYP19A1 | |
| SCHEMBL24414502 | 0.87 | AR (0.80) | ARALDH1A1CYP19A1KMT2AMEN1 | |
| SCHEMBL24414597 | 0.84 | AR (0.65) | AR | |
| SCHEMBL24411064 | 0.84 | AR (0.76) | ARCYP19A1MAOAMAOBGAA | |
| SCHEMBL24411088 | 0.84 | AR (0.76) | ARCYP19A1 | |
| SCHEMBL21996432 | 0.84 | AR (0.76) | ARCYP19A1 | |
| SCHEMBL6468792 | 0.83 | AR (0.80) | ARGRIN1GRIN2BMAPTALDH1A1 | |
| SCHEMBL20051214 | 0.82 | AR (0.72) | ARCYP19A1 | |
| SCHEMBL6465872 | 0.82 | AR (0.76) | ARCYP19A1 | |
| SCHEMBL6468062 | 0.80 | AR (1.00) | ARMAPTALDH1A1KDM4EKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018066545-A1 | HETEROCYCLIC COMPOUND | 公益財団法人ヒューマンサイエンス振興財団 | 2018-04-12 | — | — | WO | disclosed |