Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 2/20 | 0.31 |
| ▸ | AR | P10275 | 3/20 | 0.31 |
| ▸ | PDE4A | P27815 | 1/20 | 0.31 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.31 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.31 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | GLA | P06280 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | BCAT2 | O15382 | 2/20 | 0.30 |
| ▸ | BCAT1 | P54687 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8906963 | 0.88 | L3MBTL1 (0.36) | TRPV4PGRARPDE4APDE4B | |
| SCHEMBL9023596 | 0.81 | — | — | |
| SCHEMBL6984955 | 0.79 | BCAT2 (0.36) | PDE4APDE4BPDE4CPDE4DKDM4E | |
| SCHEMBL8425512 | 0.79 | TRPV4 (0.35) | TRPV4PGRPDE4APDE4BPDE4C | |
| SCHEMBL7010249 | 0.78 | KMT2A (0.36) | PGRARKDM4EALDH1A1GLA | |
| SCHEMBL8594988 | 0.78 | L3MBTL1 (0.34) | PGRKDM4EALDH1A1GLAGAA | |
| SCHEMBL8381949 | 0.78 | L3MBTL1 (0.34) | PGRKDM4EALDH1A1GLAGAA | |
| SCHEMBL6987528 | 0.78 | SMN1; SMN2 (0.32) | GAABCAT2BCAT1 | |
| SCHEMBL7030310 | 0.76 | L3MBTL1 (0.40) | PGRARKDM4EALDH1A1GLA | |
| SCHEMBL8541763 | 0.76 | GAA (0.34) | PGRARKDM4EGAAHPGD |
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 |