Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 2/20 | 0.40 |
| ▸ | PLA2G4B | P0C869 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | RXRA | P19793 | 2/20 | 0.35 |
| ▸ | HNF4A | P41235 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | RXRB | P28702 | 1/20 | 0.35 |
| ▸ | ANPEP | P15144 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | RARB | P10826 | 1/20 | 0.34 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.33 |
| ▸ | ADRB3 | P13945 | 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 | |
|---|---|---|---|---|
| SCHEMBL18259815 | 0.80 | NPC1 (0.52) | EPHX1SMN1; SMN2ALDH1A1MAPK1TSHR | |
| SCHEMBL29798859 | 0.73 | NPC1 (0.58) | EPHX1SMN1; SMN2ALDH1A1MAPK1TSHR | |
| SCHEMBL18918566 | 0.70 | SMN1; SMN2 (0.57) | EPHX1SMN1; SMN2MAPT | |
| SCHEMBL1842790 | 0.69 | RXRA (0.47) | PLA2G4BSMN1; SMN2RXRAALDH1A1MAPK1 | |
| SCHEMBL3992953 | 0.68 | RARB (0.69) | PLA2G4BMAPK1SRD5A2TP53TSHR | |
| SCHEMBL18259868 | 0.68 | POLB (0.61) | EPHX1SMN1; SMN2ALDH1A1MAPK1TSHR | |
| SCHEMBL3717942 | 0.67 | EPHX1 (0.48) | EPHX1TSHR | |
| SCHEMBL19455891 | 0.67 | MEN1 (0.47) | EPHX1SMN1; SMN2ALDH1A1MAPK1TP53 | |
| SCHEMBL560070 | 0.67 | HTT (0.55) | EPHX1MAPK1TSHRMAPT | |
| Terephthalic Acid SCHEMBL11348710 | 0.66 | ALDH1A1 (0.52) | PLA2G4BSMN1; SMN2RXRAALDH1A1MAPK1 |
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-3303333-B1 | COMPOUNDS HAVING MUSCARINIC RECEPTOR ANTAGONIST AND BETA2 ADRENERGIC RECEPTOR AGONIST ACTIVITY | CHIESI FARM SPA (IT) | 2019-11-20 | — | — | EP | disclosed |