Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | DRD1 | P21728 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.38 |
| ▸ | KCNN4 | O15554 | 4/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | DHFR | P00374 | 1/20 | 0.34 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.33 |
| ▸ | FEN1 | P39748 | 1/20 | 0.33 |
| ▸ | APLNR | P35414 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
| ▸ | ATR | Q13535 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3399496 | 0.85 | CHRNA7 (0.47) | ADORA2AADORA1HSP90AA1MAOBHSP90AB1 | |
| SCHEMBL3393346 | 0.80 | HSP90AA1 (0.59) | ADORA2AADORA1HSP90AA1HSP90AB1CHRNA7 | |
| SCHEMBL3398117 | 0.79 | MPL (0.44) | ADORA2AADORA1HSP90AA1MAOBTRPA1 | |
| SCHEMBL30507526 | 0.78 | HSP90AA1 (0.47) | ADORA2ADRD1HSP90AA1MAOBHSP90AB1 | |
| SCHEMBL3394031 | 0.78 | NCOA1 (0.44) | ADORA2AADORA1HSP90AA1MAOBHSP90AB1 | |
| SCHEMBL28512809 | 0.78 | HSP90AA1 (0.47) | ADORA2ADRD1HSP90AA1MAOBHSP90AB1 | |
| SCHEMBL3397291 | 0.77 | MAOB (0.47) | ADORA2AADORA1HSP90AA1MAOBHSP90AB1 | |
| SCHEMBL20262993 | 0.75 | CYP2D6 (0.48) | ADORA2AADORA1DRD1KCNN4DHFR | |
| SCHEMBL29870173 | 0.75 | CYP2D6 (0.48) | ADORA2AADORA1DRD1KCNN4DHFR | |
| SCHEMBL2324805 | 0.74 | MPL (0.50) | ADORA2AADORA1ALOX5APFEN1ATR |
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-2010046780-A2 | ANTI VIRAL COMPOUNDS | INSTITUT PASTEUR KOREA (KR) | 2010-04-29 | — | — | WO | disclosed |