Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | TSPO | P30536 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | RAD52 | P43351 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL20071442 | 0.91 | CYP2A6 (0.34) | CYP2A6ALDH1A1TDP1MEN1KMT2A | |
| SCHEMBL28842820 | 0.86 | TDP1 (0.38) | CYP2A6ALDH1A1TDP1 | |
| SCHEMBL28842677 | 0.86 | TSPO (0.41) | TSPOALDH1A1TDP1MEN1RAD52 | |
| SCHEMBL26529778 | 0.84 | MAPT (0.37) | CYP2A6TSPOALDH1A1MEN1RAD52 | |
| SCHEMBL20068466 | 0.78 | CYP2A6 (0.39) | CYP2A6TSPOALDH1A1MEN1RAD52 | |
| SCHEMBL20068638 | 0.78 | CYP2A6 (0.39) | CYP2A6TSPOALDH1A1MEN1RAD52 | |
| SCHEMBL29476073 | 0.77 | TSPO (0.41) | CYP2A6TSPOALDH1A1TDP1MEN1 | |
| SCHEMBL490271 | 0.77 | TSPO (0.41) | CYP2A6TSPOALDH1A1TDP1MEN1 | |
| SCHEMBL19890650 | 0.77 | CYP2A6 (0.36) | CYP2A6ALDH1A1MEN1KMT2A | |
| SCHEMBL2019199 | 0.76 | TDP1 (0.40) | CYP2A6TSPOALDH1A1TDP1MEN1 |
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-2018070836-A1 | COMPOUND FOR ORGANIC ELECTRONIC DEVICE, ORGANIC ELECTRONIC DEVICE USING SAME AND ELECTRONIC APPARATUS THEREFOR | 덕산네오룩스 주식회사 | 2018-04-19 | — | — | WO | disclosed |