Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.64 |
| ▸ | RAB9A | P51151 | 5/20 | 0.64 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | GLA | P06280 | 2/20 | 0.49 |
| ▸ | RUNX1 | Q01196 | 2/20 | 0.49 |
| ▸ | CBFB | Q13951 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.49 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | AXL | P30530 | 1/20 | 0.46 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.46 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.46 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL24795860 | 0.84 | NPC1 (0.56) | NPC1RAB9AKDM4EALDH1A1GLA | |
| SCHEMBL23458472 | 0.83 | KDM4E (0.59) | NPC1RAB9AKDM4EALDH1A1GLA | |
| SCHEMBL13053004 | 0.82 | PDK1 (0.55) | NPC1RAB9AKDM4EALDH1A1GLA | |
| SCHEMBL13998684 | 0.82 | KDM4E (0.61) | NPC1RAB9AKDM4EALDH1A1GLA | |
| SCHEMBL17803443 | 0.82 | RAB9A (0.55) | NPC1RAB9ACYP2A6KDM4EALDH1A1 | |
| SCHEMBL17803417 | 0.80 | RAB9A (0.56) | NPC1RAB9ACYP2A6KDM4EALDH1A1 | |
| SCHEMBL17803424 | 0.80 | RAB9A (0.55) | NPC1RAB9ACYP2A6KDM4EALDH1A1 | |
| SCHEMBL17803418 | 0.80 | RAB9A (0.55) | NPC1RAB9ACYP2A6KDM4EALDH1A1 | |
| SCHEMBL19360869 | 0.80 | RAB9A (0.55) | NPC1RAB9ACYP2A6KDM4EALDH1A1 | |
| SCHEMBL17803423 | 0.80 | NPC1 (0.55) | NPC1RAB9ACYP2A6KDM4EALOX5 |
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-3227303-B1 | BICYCLIC COMPOUNDS AS PEST CONTROLLERS | BAYER CROPSCIENCE AG (DE) | 2018-10-24 | — | — | EP | disclosed |