Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | AR | P10275 | 5/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL9023737 | 0.73 | MAPT (0.44) | MAPTGAAHPGDMEN1ALDH1A1 | |
| SCHEMBL8188639 | 0.73 | BCAT2 (0.61) | — | |
| SCHEMBL8420147 | 0.72 | BCAT2 (0.41) | CYP11B2ALDH1A1 | |
| SCHEMBL8420225 | 0.68 | BCAT2 (0.41) | MAPTARMEN1KMT2A | |
| SCHEMBL1361513 | 0.64 | AR (0.50) | MAPTHPGDARCYP11B2ALDH1A1 | |
| SCHEMBL5420508 | 0.63 | CTSK (0.47) | ARCYP11B2 | |
| SCHEMBL1573401 | 0.63 | BCAT2 (0.58) | — | |
| SCHEMBL1574267 | 0.63 | AR (0.38) | GAAAR | |
| SCHEMBL31346316 | 0.63 | AR (0.54) | AR | |
| SCHEMBL7537781 | 0.63 | BCAT2 (0.45) | MAPTMEN1ALDH1A1KMT2A |
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-0736014-A1 | N-CYANOARYL NITROGEN HETEROCYCLES WITH SULPHUR-CONTAINING GROUPINGS | BAYER AG (DE) | 1996-10-09 | — | — | EP | disclosed |