Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 6/20 | 0.39 |
| ▸ | HSD17B2 | P37059 | 6/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.39 |
| ▸ | CYP2B6 | P20813 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.39 |
| ▸ | WDR5 | P61964 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.36 |
| ▸ | HPRT1 | P00492 | 3/20 | 0.36 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.35 |
| ▸ | PLK1 | P53350 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18821313 | 0.79 | HPRT1 (0.43) | WDR5ALOX5HPRT1SOS1ALDH1A1 | |
| SCHEMBL18821319 | 0.77 | HPRT1 (0.41) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL20243663 | 0.73 | PRSS1 (0.46) | MAPT | |
| SCHEMBL19336435 | 0.73 | ALDH1A1 (0.56) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL311937 | 0.72 | ESR1 (0.46) | HSD17B1HSD17B2CYP3A4CYP2C9ALOX5 | |
| SCHEMBL311659 | 0.72 | ESR1 (0.46) | HSD17B1HSD17B2CYP3A4CYP2C9ALOX5 | |
| SCHEMBL20404983 | 0.72 | HPRT1 (0.48) | CYP1A2CYP3A4ALOX5HPRT1ALDH1A1 | |
| SCHEMBL22639444 | 0.72 | ALOX5 (0.58) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL22639386 | 0.70 | MAPT (0.38) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL20405106 | 0.70 | MAPT (0.38) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2D6 |
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-2017074052-A1 | ORGANIC LIGHT-EMITTING DEVICE | 주식회사 엘지화학 | 2017-05-04 | — | — | WO | disclosed |