Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 5/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.53 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.53 |
| ▸ | AXL | P30530 | 1/20 | 0.53 |
| ▸ | CYP11B1 | P15538 | 6/20 | 0.51 |
| ▸ | CYP11B2 | P19099 | 6/20 | 0.51 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.51 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.51 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.50 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.50 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.50 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.49 |
| ▸ | AURKA | O14965 | 1/20 | 0.49 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.49 |
| ▸ | JAK2 | O60674 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL18216637 | 1.00 | CYP2A6 (0.54) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 | |
| SCHEMBL13624520 | 0.98 | CYP2A6 (0.56) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 | |
| SCHEMBL13537049 | 0.96 | CYP2A6 (0.58) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 | |
| SCHEMBL12145548 | 0.91 | CYP2A6 (0.65) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 | |
| SCHEMBL13231660 | 0.91 | PIK3CD (0.47) | MAP4K4ABL1 | |
| SCHEMBL17055536 | 0.89 | CYP2A6 (0.62) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 | |
| SCHEMBL24157422 | 0.88 | MKNK1 (0.57) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 | |
| SCHEMBL22428551 | 0.84 | CYP2A6 (0.75) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 | |
| SCHEMBL22428556 | 0.84 | CYP2A6 (0.75) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 | |
| SCHEMBL12129614 | 0.84 | CYP2A6 (0.75) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 |
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-3214665-A1 | RED ORGANIC ELECTROLUMINESCENT DEVICE AND PREPARATION METHOD THEREOF | Changchun Institute Of Applied Chemistry Chinese Academy Of Sciences (CN) | 2017-09-06 | — | — | EP | disclosed |