Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 3/20 | 0.40 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.36 |
| ▸ | THRA | P10827 | 2/20 | 0.36 |
| ▸ | THRB | P10828 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MET | P08581 | 1/20 | 0.35 |
| ▸ | YWHAG | P61981 | 1/20 | 0.35 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | LCK | P06239 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1670905 | 0.88 | NUDT1 (0.42) | APPNUDT1BACE1THRATHRB | |
| SCHEMBL1668329 | 0.83 | NUDT1 (0.40) | APPNUDT1BACE1THRATHRB | |
| SCHEMBL12801311 | 0.81 | NUDT1 (0.43) | APPNUDT1BACE1THRATHRB | |
| SCHEMBL12800404 | 0.73 | CHRM5 (0.40) | APP | |
| SCHEMBL12801191 | 0.72 | CHRM5 (0.46) | APP | |
| SCHEMBL7794845 | 0.70 | NUDT1 (0.67) | NUDT1BACE1THRATHRBFFAR4 | |
| SCHEMBL1668648 | 0.69 | RXRA (0.41) | APPGAA | |
| SCHEMBL13886150 | 0.68 | L3MBTL1 (0.56) | THRATHRBALDH1A1TDP1FFAR4 | |
| SCHEMBL3589323 | 0.67 | FFAR1 (0.51) | SIGMAR1TSHRTDP1FFAR4 | |
| SCHEMBL1668599 | 0.67 | RXRA (0.38) | APPALOX5FFAR4 |
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-2011048409-A1 | CYCLIC AMINE DERIVATIVES HAVING BETA2 ADRENERGIC RECEPTOR AGONIST AND MUSCARINIC RECEPTOR ANTAGONIST ACTIVITY | ASTRAZENECA AB (SE) | 2011-04-28 | — | — | WO | disclosed |