Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM5 | P08912 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.38 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.36 |
| ▸ | FBP1 | P09467 | 2/20 | 0.36 |
| ▸ | CHAT | P28329 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.35 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.35 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.35 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.35 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.35 |
| ▸ | RELA | Q04206 | 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 | |
|---|---|---|---|---|
| SCHEMBL7971923 | 0.86 | CHRM5 (0.47) | CHRM5CYP1A2CYP2D6CYP2C9CYP3A4 | |
| SCHEMBL8441256 | 0.80 | HTT (0.44) | ALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL3300271 | 0.78 | CHRM5 (0.62) | CHRM5CYP1A2CYP2D6CYP2C9FBP1 | |
| SCHEMBL8435518 | 0.77 | CYP1A1 (0.54) | CHRM5CYP1A2CYP2D6CYP3A4CYP1A1 | |
| SCHEMBL4148570 | 0.76 | MAPK1 (0.41) | CHRM5CYP1A2CYP2D6CYP2C9CYP3A4 | |
| SCHEMBL8485821 | 0.73 | VCP (0.41) | — | |
| SCHEMBL7969830 | 0.73 | TP53 (0.43) | CHRM5CYP1A2CYP2C9CYP3A4DAPK3 | |
| SCHEMBL8436212 | 0.73 | CYP11B2 (0.39) | CHRM5MAPT | |
| SCHEMBL3301775 | 0.72 | CHRM5 (0.56) | CHRM5CYP1A2CYP2D6CYP2C9FBP1 | |
| SCHEMBL8441257 | 0.72 | CHRM5 (0.56) | CHRM5CYP1A2CYP2D6CYP2C9FBP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5968947-A | INSECTICIDES, ACARICIDES, NEMATOCIDES | ZENECA LIMITED (GB) | 1999-10-19 | — | — | US | disclosed |