Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 7/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 6/20 | 0.41 |
| ▸ | TACR1 | P25103 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | ITGA2 | P17301 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 4/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL1670822 | 0.96 | ITGB3 (0.42) | ITGB3ITGA2BTACR1ITGA2TP53 | |
| SCHEMBL1670831 | 0.89 | SMN1; SMN2 (0.36) | ITGB3ITGA2BTACR1SMN1; SMN2ITGA2 | |
| SCHEMBL1670823 | 0.85 | ITGB3 (0.36) | ITGB3ITGA2BTACR1SMN1; SMN2ITGA2 | |
| SCHEMBL1670835 | 0.82 | OPRM1 (0.43) | SMN1; SMN2NPC1RAB9ATP53HTT | |
| SCHEMBL1668840 | 0.79 | NAMPT (0.42) | TP53OPRM1CA2POLB | |
| SCHEMBL12800418 | 0.76 | OPRM1 (0.40) | ITGB3ITGA2BTACR1OPRM1 | |
| Trifluoroacetic Acid SCHEMBL1668669 | 0.74 | APP (0.35) | TACR1PDK2 | |
| SCHEMBL12800770 | 0.73 | OPRD1 (0.42) | TACR1SMN1; SMN2HTTOPRM1 | |
| Trifluoroacetic Acid SCHEMBL1668616 | 0.71 | FFAR4 (0.43) | TACR1 | |
| SCHEMBL1669606 | 0.71 | CA12 (0.47) | SMN1; SMN2TP53HTTPDK2OPRM1 |
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 |