Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.49 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.49 |
| ▸ | RPS6KA5 | O75582 | 2/20 | 0.42 |
| ▸ | AKT1 | P31749 | 2/20 | 0.42 |
| ▸ | GSK3B | P49841 | 2/20 | 0.42 |
| ▸ | NEK4 | P51957 | 2/20 | 0.42 |
| ▸ | PRKCD | Q05655 | 2/20 | 0.42 |
| ▸ | PRKG2 | Q13237 | 2/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.42 |
| ▸ | PRKG1 | Q13976 | 2/20 | 0.42 |
| ▸ | PKN2 | Q16513 | 2/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.42 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.42 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.42 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.42 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.42 |
| ▸ | PRKCG | P05129 | 1/20 | 0.42 |
| ▸ | CDK1 | P06493 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7093029 | 0.82 | TAAR1 (0.50) | CHRNB2CHRNA4RPS6KA5AKT1GSK3B | |
| SCHEMBL27220939 | 0.75 | CHRNB2 (0.53) | CHRNB2CHRNA4RPS6KA5AKT1GSK3B | |
| SCHEMBL11781440 | 0.74 | ALDH1A1 (0.55) | RPS6KB1 | |
| Hydrochloric Acid SCHEMBL9001664 | 0.73 | CHRNB2 (0.55) | CHRNB2CHRNA4RPS6KA5AKT1GSK3B | |
| SCHEMBL29157126 | 0.72 | CTSA (0.51) | MMP8MMP14CA14 | |
| SCHEMBL8790210 | 0.71 | MAPT (0.56) | CHRNB2CHRNA4TAAR1 | |
| SCHEMBL27220938 | 0.71 | CHRNB2 (0.49) | CHRNB2CHRNA4RPS6KA5AKT1GSK3B | |
| SCHEMBL31147717 | 0.71 | MAOA (0.40) | CHRNB2CHRNA4ROCK1ROCK2CA2 | |
| SCHEMBL11203104 | 0.68 | HRH1 (0.54) | RPS6KB1TAAR1 | |
| SCHEMBL10780978 | 0.68 | ALDH1A1 (0.61) | RPS6KB1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016028110-A1 | A PLURALITY OF HOST MATERIALS AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE SAME | ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) | 2016-02-25 | — | — | WO | disclosed |