Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20649622 | 0.87 | MEN1 (0.32) | — | |
| SCHEMBL20650714 | 0.84 | — | — | |
| SCHEMBL23967855 | 0.84 | — | — | |
| SCHEMBL20649627 | 0.84 | — | — | |
| SCHEMBL20650711 | 0.84 | NR1I2 (0.32) | SIGMAR1 | |
| SCHEMBL20649832 | 0.83 | TNKS (0.33) | — | |
| SCHEMBL20649629 | 0.83 | ALDH1A1 (0.32) | CYP2A6ALDH1A1 | |
| SCHEMBL21021492 | 0.83 | CHKA (0.36) | CYP2A6ALDH1A1CYP1A2SIGMAR1 | |
| SCHEMBL20650364 | 0.82 | ACHE (0.36) | CYP2A6ALDH1A1CYP1A2 | |
| SCHEMBL20650751 | 0.81 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3428152-B1 | COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME | LG CHEMICAL LTD (KR) | 2021-11-03 | — | — | EP | disclosed |
| EP-3428152-A1 | COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME | LG Chem, Ltd. (KR) | 2019-01-16 | — | — | EP | disclosed |