Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 2/20 | 0.34 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL29399101 | 0.72 | HSD17B10 (0.44) | ALDH1A1HSD17B10TDP1CYP2A6TSHR | |
| SCHEMBL2290546 | 0.72 | HSD17B10 (0.44) | ALDH1A1HSD17B10TDP1CYP2A6TSHR | |
| SCHEMBL6545899 | 0.71 | ALDH1A1 (0.52) | ALDH1A1HSD17B10TDP1CYP2A6TSHR | |
| Benzene SCHEMBL1724439 | 0.71 | HSD17B10 (0.42) | ALDH1A1HSD17B10TDP1CYP2A6TSHR | |
| SCHEMBL31450268 | 0.71 | HSD17B10 (0.42) | ALDH1A1HSD17B10TDP1CYP2A6TSHR | |
| SCHEMBL29636355 | 0.70 | CES1 (0.46) | ALDH1A1HSD17B10TDP1CYP2A6TSHR | |
| SCHEMBL4850615 | 0.69 | ALDH1A1 (0.55) | ALDH1A1HSD17B10TDP1CYP2A6TSHR | |
| SCHEMBL4623560 | 0.68 | ALDH1A1 (0.44) | ALDH1A1HSD17B10TDP1CYP2A6TSHR | |
| SCHEMBL29442976 | 0.68 | ALDH1A1 (0.44) | ALDH1A1HSD17B10TDP1CYP2A6TSHR | |
| SCHEMBL12475251 | 0.68 | HPRT1 (0.52) | ALDH1A1HSD17B10TDP1CYP2A6TSHR |
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-3127988-B1 | ORGANIC LIGHT-EMITTING DEVICE | LG CHEMICAL LTD (KR) | 2018-03-14 | — | — | EP | disclosed |