Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 3/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | PRNP | P04156 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.40 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1191770 | 0.95 | CYP2A6 (0.55) | CYP2A6ESR1ESR2MEN1KMT2A | |
| SCHEMBL30200392 | 0.95 | CYP2A6 (0.55) | CYP2A6ESR1ESR2MEN1KMT2A | |
| SCHEMBL761316 | 0.93 | CYP2A6 (0.57) | CYP2A6ESR1ESR2MEN1KMT2A | |
| SCHEMBL16603673 | 0.92 | CYP2A6 (0.48) | CYP2A6ESR1ESR2MEN1KMT2A | |
| SCHEMBL10458839 | 0.92 | CYP2A6 (0.52) | CYP2A6ESR1ESR2MEN1KMT2A | |
| SCHEMBL12877798 | 0.92 | CYP2A6 (0.55) | CYP2A6ESR1ESR2MEN1KMT2A | |
| SCHEMBL4659171 | 0.90 | CYP2A6 (0.52) | CYP2A6ESR1ESR2MEN1KMT2A | |
| SCHEMBL9914822 | 0.89 | CYP2A6 (0.57) | CYP2A6ESR1ESR2MEN1KMT2A | |
| SCHEMBL20022163 | 0.88 | CYP2A6 (0.50) | CYP2A6ESR1ESR2MEN1KMT2A | |
| SCHEMBL9914792 | 0.88 | CYP2A6 (0.54) | CYP2A6ESR1ESR2MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-113454798-B | Organic light emitting device | 株式会社LG化学 | 2025-03-07 | — | — | CN | disclosed |
| CN-113454798-A | Organic light emitting device | 株式会社LG化学 | 2021-09-28 | — | — | CN | disclosed |