Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | TSPO | P30536 | 1/20 | 0.32 |
| ▸ | AURKA | O14965 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.30 |
| ▸ | RAD52 | P43351 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 2/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | BCHE | P06276 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20068466 | 1.00 | CYP2A6 (0.39) | CYP2A6ALDH1A1TSPOAURKAKDM4E | |
| SCHEMBL28842677 | 0.86 | TSPO (0.41) | ALDH1A1TSPOKDM4EATML3MBTL1 | |
| SCHEMBL19890650 | 0.82 | CYP2A6 (0.36) | CYP2A6ALDH1A1KDM4EATML3MBTL1 | |
| SCHEMBL26529778 | 0.81 | MAPT (0.37) | CYP2A6ALDH1A1TSPOAURKAL3MBTL1 | |
| SCHEMBL26557754 | 0.80 | L3MBTL1 (0.55) | CYP2A6ALDH1A1TSPOAURKAKDM4E | |
| SCHEMBL20071442 | 0.80 | CYP2A6 (0.34) | CYP2A6ALDH1A1MEN1KMT2A | |
| SCHEMBL20071701 | 0.78 | CYP2A6 (0.32) | CYP2A6ALDH1A1TSPOMEN1KMT2A | |
| SCHEMBL20068679 | 0.78 | ALDH1A1 (0.34) | ALDH1A1KDM4EATML3MBTL1MEN1 | |
| SCHEMBL30300783 | 0.78 | ACHE (0.40) | CYP2A6ALDH1A1TSPOAURKAKDM4E | |
| SCHEMBL26241798 | 0.78 | KDM4E (0.39) | CYP2A6ALDH1A1TSPOAURKAKDM4E |
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-2018070824-A1 | COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF | 덕산네오룩스 주식회사 | 2018-04-19 | — | — | WO | disclosed |