Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 4/20 | 0.45 |
| ▸ | CHAT | P28329 | 2/20 | 0.45 |
| ▸ | FBP1 | P09467 | 1/20 | 0.45 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.44 |
| ▸ | RELA | Q04206 | 2/20 | 0.44 |
| ▸ | MAOA | P21397 | 2/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL699004 | 0.89 | CHAT (0.51) | CYP1A2CYP2C9MAOBCHATFBP1 | |
| SCHEMBL699005 | 0.89 | CHAT (0.51) | CYP1A2CYP2C9MAOBCHATFBP1 | |
| SCHEMBL11471054 | 0.84 | CYP1A2 (0.61) | CYP1A2CYP2C9MAOBCHATFBP1 | |
| SCHEMBL11319367 | 0.83 | MAOB (0.61) | CYP1A2CYP2C9MAOBCHATRELA | |
| SCHEMBL11319372 | 0.83 | MAOB (0.61) | CYP1A2CYP2C9MAOBCHATRELA | |
| SCHEMBL13291663 | 0.83 | MAOB (0.61) | CYP1A2CYP2C9MAOBCHATFBP1 | |
| SCHEMBL11461138 | 0.80 | ALDH1A1 (0.56) | CYP1A2CYP2C9MAOBCHATRELA | |
| SCHEMBL11468743 | 0.79 | NFE2L2 (0.52) | CYP1A2CYP2C9MAOBCHATRELA | |
| SCHEMBL10137939 | 0.78 | ALDH1A1 (0.54) | CYP1A2CYP2C9MAOBCHATRELA | |
| 3-Chloro-Cinnamic Acid SCHEMBL7753489 | 0.78 | MAOB (0.60) | CYP1A2CYP2C9MAOBMAOACYP1A1 |
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-0370753-B1 | Modified polyolefin particles and process for preparation thereof | MITSUI PETROCHEMICAL IND (JP) | 1995-01-18 | — | — | EP | disclosed |