Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | PRKDC | P78527 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.32 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.31 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22056435 | 0.92 | NPC1 (0.42) | NPC1RAB9ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL22056442 | 0.89 | MEN1 (0.38) | NPC1RAB9AGABRA1GABRG2GABRB3 | |
| SCHEMBL18818876 | 0.87 | NPC1 (0.44) | NPC1RAB9AGABRA1GABRG2GABRB3 | |
| SCHEMBL21160253 | 0.86 | NPC1 (0.38) | NPC1RAB9APRKDCSLC6A2SLC6A4 | |
| SCHEMBL18818882 | 0.85 | ALDH1A3 (0.37) | NPC1RAB9AGABRA1GABRG2GABRB3 | |
| SCHEMBL21159691 | 0.85 | PGR (0.36) | NPC1RAB9AMEN1ALDH1A1CYP1A2 | |
| SCHEMBL21159977 | 0.83 | NPC1 (0.46) | NPC1RAB9AGABRA1GABRG2GABRB3 | |
| SCHEMBL22056443 | 0.83 | ESR2 (0.36) | NPC1RAB9ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL24747326 | 0.82 | NPC1 (0.43) | NPC1RAB9ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL21160342 | 0.82 | NPC1 (0.38) | NPC1RAB9ASLC6A2SLC6A4SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3498804-B1 | ORGANIC LIGHT EMITTING DEVICE | LG CHEMICAL LTD (KR) | 2020-06-03 | — | — | EP | disclosed |
| EP-3498804-A1 | ORGANIC LIGHT EMITTING DEVICE | LG Chem, Ltd. (KR) | 2019-06-19 | — | — | EP | disclosed |