Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 5/20 | 0.46 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.39 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.34 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.34 |
| ▸ | EIF4E | P06730 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.30 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14934098 | 0.80 | CYP2A6 (0.38) | CYP2A6PDGFRBPDGFRACHRNB2CHRNA4 | |
| SCHEMBL17619558 | 0.75 | PDPK1 (0.43) | CYP2A6CHRNB2CHRNA4NPC1MAPT | |
| SCHEMBL14934123 | 0.73 | PDGFRB (0.48) | CYP2A6PDGFRBPDGFRACYP3A4CYP2B6 | |
| SCHEMBL17067721 | 0.71 | ERN1 (0.40) | — | |
| SCHEMBL17067679 | 0.70 | CHRNB2 (0.36) | CHRNB2CHRNA4 | |
| SCHEMBL17067677 | 0.70 | KDM4E (0.42) | NPC1GAAMAPTRAB9A | |
| SCHEMBL2554717 | 0.69 | ALDH1A1 (0.47) | PDGFRBPDGFRAESR2NPC1MAPT | |
| SCHEMBL25699202 | 0.69 | RAF1 (0.39) | CHRNB2CHRNA4 | |
| SCHEMBL25983846 | 0.69 | PLA2G7 (0.54) | CYP3A4NPC1RAB9A | |
| SCHEMBL14934094 | 0.68 | PDGFRB (0.49) | PDGFRBPDGFRACYP3A4CYP2C19NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2773631-B1 | PESTICIDAL COMPOUNDS | SYNGENTA PARTICIPATIONS AG (CH) | 2015-09-09 | — | — | EP | disclosed |
| WO-2013064519-A1 | PESTICIDAL COMPOUNDS | SYNGENTA PARTICIPATIONS AG (CH) | 2013-05-10 | — | — | WO | disclosed |