Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.45 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.43 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | NQO2 | P16083 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31197633 | 1.00 | APP (0.45) | APPCYP2A6CYP2E1CYP3A4CYP2C9 | |
| SCHEMBL13539332 | 0.89 | HSD17B1 (0.48) | APPCYP2A6CYP2E1CYP3A4CYP2C9 | |
| SCHEMBL14190038 | 0.87 | HSD17B1 (0.56) | APPCYP2A6CYP2E1CYP3A4CYP2C9 | |
| SCHEMBL12854019 | 0.85 | HSD17B1 (0.54) | APPCYP2A6CYP2E1CYP3A4CYP2C9 | |
| SCHEMBL14190043 | 0.85 | HSD17B1 (0.54) | APPCYP2A6CYP2E1CYP3A4CYP2C9 | |
| SCHEMBL13539341 | 0.84 | HSD17B1 (0.48) | APPCYP2A6CYP2E1CYP3A4CYP2C9 | |
| SCHEMBL11522149 | 0.82 | RXFP1 (0.45) | APPCYP2A6CYP2E1CYP3A4CYP2C9 | |
| Hydrochloric Acid SCHEMBL27634388 | 0.81 | ALDH1A1 (0.58) | CYP2A6ALDH1A1HSD17B10HPGDBCL2L1 | |
| SCHEMBL14515085 | 0.80 | CYP2A6 (0.40) | APPCYP2A6CYP2E1CYP3A4CYP2C9 | |
| SCHEMBL7591649 | 0.78 | HSD17B1 (0.62) | APPCYP2A6CYP2E1CYP3A4CYP2C9 |
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-3327815-A1 | LIGHT-EMITTING DEVICE | IMEC vzw (BE) | 2018-05-30 | — | — | EP | disclosed |