Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | GMNN | O75496 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | BLM | P54132 | 2/20 | 0.36 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14948324 | 0.84 | CYP1A2 (0.42) | CYP1A2CYP2D6CYP2C19CHRM2CHRM1 | |
| SCHEMBL7919050 | 0.82 | CYP2D6 (0.59) | CYP1A2CYP2D6CYP2C19SIGMAR1CHRM2 | |
| Iodide SCHEMBL30254970 | 0.81 | CYP1A2 (0.57) | CYP1A2CYP2D6CYP2C19CHRM2CHRM1 | |
| Hydrochloric Acid SCHEMBL10800502 | 0.81 | CYP1A2 (0.57) | CYP1A2CYP2D6CYP2C19CHRM2CHRM1 | |
| SCHEMBL14948472 | 0.78 | CYP2D6 (0.42) | CYP1A2CYP2D6CYP2C19SIGMAR1CYP2C9 | |
| SCHEMBL516020 | 0.76 | SIGMAR1 (0.56) | CYP1A2CYP2D6CYP2C19SIGMAR1CYP2C9 | |
| SCHEMBL29870751 | 0.76 | SIGMAR1 (0.56) | CYP1A2CYP2D6CYP2C19SIGMAR1CYP2C9 | |
| SCHEMBL6568773 | 0.76 | SIGMAR1 (0.56) | CYP1A2CYP2D6CYP2C19SIGMAR1CYP2C9 | |
| SCHEMBL12744236 | 0.70 | CYP2A6 (0.54) | CYP1A2CYP2D6CYP2C19SIGMAR1ALDH1A1 | |
| SCHEMBL13432619 | 0.70 | SIGMAR1 (0.44) | CYP1A2CYP2D6CYP2C19SIGMAR1ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9184388-B2 | Layered structure, electronic device using same, aromatic compound, and method for manufacturing said compound | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2015-11-10 | — | — | US | disclosed |
| US-20130119369-A1 | LAYERED STRUCTURE, ELECTRONIC DEVICE USING SAME, AROMATIC COMPOUND, AND METHOD FOR MANUFACTURING SAID COMPOUND | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2013-05-16 | — | — | US | disclosed |