Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.36 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.36 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.36 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | GSK3A | P49840 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL17535276 | 0.78 | CYP2A6 (0.39) | ADORA3MAPK1MAPK13MAPK12MAPK11 | |
| SCHEMBL17802507 | 0.77 | ESR2 (0.49) | ADORA3ESR2MAPK1ALDH1A1HTT | |
| SCHEMBL31457215 | 0.77 | ESR2 (0.49) | ADORA3ESR2MAPK1ALDH1A1HTT | |
| SCHEMBL19581840 | 0.76 | MAPT (0.48) | ADORA3ESR2MAPK1ALDH1A1NPC1 | |
| SCHEMBL17535302 | 0.75 | MAPK1 (0.38) | ADORA3MAPK1ALDH1A1HTTNPC1 | |
| SCHEMBL17812241 | 0.74 | NAMPT (0.50) | ADORA3MAPK1ALDH1A1HTTNPC1 | |
| SCHEMBL20548970 | 0.74 | ADORA3 (0.43) | ADORA3ESR2MAPK1ALDH1A1HTT | |
| SCHEMBL23320422 | 0.74 | NR1H2 (0.37) | ESR2NPC1RAB9AMAPTLMNA | |
| SCHEMBL17802509 | 0.74 | ESR2 (0.46) | ADORA3ESR2MAPK1ALDH1A1HTT | |
| SCHEMBL18049322 | 0.74 | NAPRT (0.48) | ADORA3ESR2MAPK1ALDH1A1NPC1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3227274-B1 | BICYCLIC COMPOUNDS AS PEST CONTROLLERS | BAYER CROPSCIENCE AG (DE) | 2019-07-03 | — | — | EP | disclosed |
| EP-3227274-A1 | BICYCLIC COMPOUNDS AS PEST CONTROL AGENTS | Bayer CropScience Aktiengesellschaft (DE) | 2017-10-11 | — | — | EP | disclosed |
| WO-2016087421-A1 | BICYCLIC COMPOUNDS AS PEST CONTROL AGENTS | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2016-06-09 | — | — | WO | disclosed |