Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 1/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 3/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.36 |
| ▸ | S1PR5 | Q9H228 | 3/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | APP | P05067 | 1/20 | 0.34 |
| ▸ | FFAR4 | Q5NUL3 | 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 | |
|---|---|---|---|---|
| SCHEMBL12800404 | 0.94 | CHRM5 (0.40) | RXRACHRM5CHRM1CHRM3FFAR1 | |
| SCHEMBL1668720 | 0.91 | CHRM5 (0.43) | RXRACHRM5CHRM1CHRM3S1PR1 | |
| SCHEMBL1668322 | 0.85 | S1PR1 (0.40) | CHRM5CHRM1CHRM3S1PR1S1PR5 | |
| SCHEMBL12801191 | 0.84 | CHRM5 (0.46) | RXRACHRM5CHRM1CHRM3DRD4 | |
| SCHEMBL1668419 | 0.84 | RXRA (0.38) | RXRACHRM5CHRM1CHRM3S1PR1 | |
| SCHEMBL1668486 | 0.83 | SMN1; SMN2 (0.43) | RXRACHRM5CHRM1CHRM3FFAR1 | |
| SCHEMBL1670818 | 0.81 | FFAR4 (0.37) | RXRACHRM5CHRM1CHRM3OPRM1 | |
| SCHEMBL1668622 | 0.81 | OPRD1 (0.36) | OPRM1APPFFAR4 | |
| SCHEMBL1668421 | 0.81 | FFAR4 (0.37) | RXRACHRM5CHRM1CHRM3OPRM1 | |
| SCHEMBL12800754 | 0.80 | OPRM1 (0.33) | CHRM5CHRM1CHRM3OPRM1 |
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 2 patents. 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 |
| WO-2011048409-A1 | CYCLIC AMINE DERIVATIVES HAVING BETA2 ADRENERGIC RECEPTOR AGONIST AND MUSCARINIC RECEPTOR ANTAGONIST ACTIVITY | ASTRAZENECA AB (SE) | 2011-04-28 | — | — | WO | disclosed |