Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | HTR2B | P41595 | 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 | |
|---|---|---|---|---|
| SCHEMBL1313656 | 0.78 | CYP1A2 (0.33) | ALDH1A1CYP3A4HSD17B10CYP2D6SLC6A2 | |
| SCHEMBL5025415 | 0.78 | CYP2A6 (0.33) | CYP2D6SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL3801209 | 0.76 | HTR2A (0.42) | ALDH1A1CYP3A4HSD17B10CYP2D6SLC6A2 | |
| SCHEMBL28157984 | 0.76 | HTR2A (0.42) | ALDH1A1CYP3A4HSD17B10CYP2D6SLC6A2 | |
| SCHEMBL10878544 | 0.75 | TDP1 (0.31) | ALDH1A1CYP3A4HSD17B10CYP2D6SLC6A2 | |
| SCHEMBL28864576 | 0.75 | CES2 (0.33) | ALDH1A1CYP3A4HSD17B10SLC6A2SLC6A4 | |
| SCHEMBL10485205 | 0.75 | TSHR (0.33) | — | |
| SCHEMBL7753185 | 0.74 | CYP2D6 (0.30) | CYP2D6SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL15859481 | 0.74 | CA1 (0.32) | CYP2D6SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL28132004 | 0.74 | CYP2A6 (0.36) | CYP2D6SLC6A2SLC6A4SLC6A3KCNH2 |
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-3246963-B1 | ORGANIC LIGHT-EMITTING DEVICE | SAMSUNG DISPLAY CO LTD (KR) | 2023-05-31 | — | — | EP | disclosed |