Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.34 |
| ▸ | NQO2 | P16083 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.30 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.30 |
| ▸ | PTPN12 | Q05209 | 1/20 | 0.30 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.30 |
| ▸ | CASR | P41180 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | CASP1 | P29466 | 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 | |
|---|---|---|---|---|
| SCHEMBL24028838 | 0.78 | NQO1 (0.34) | NQO1NQO2MAPT | |
| SCHEMBL24029292 | 0.71 | NQO1 (0.32) | NQO1NQO2 | |
| SCHEMBL24029178 | 0.70 | NQO1 (0.30) | NQO1NQO2 | |
| SCHEMBL24028834 | 0.70 | NQO2 (0.45) | NQO1NQO2MAPTHPGDKDM4E | |
| SCHEMBL24028586 | 0.67 | RAB9A (0.33) | MAPTHPGDKDM4ECYP3A4TSHR | |
| SCHEMBL20983890 | 0.67 | ALDH1A1 (0.41) | MAPTHPGDALDH1A1TSHRHIF1A | |
| SCHEMBL24033899 | 0.67 | CYP3A4 (0.32) | HPGDCYP3A4TSHRMAPK1CASP1 | |
| SCHEMBL19961743 | 0.65 | NQO2 (0.41) | NQO1NQO2MAPTHPGDKDM4E | |
| SCHEMBL24028768 | 0.64 | NQO2 (0.38) | NQO1NQO2MAPTHPGDKDM4E | |
| SCHEMBL21186857 | 0.64 | HCRTR1 (0.33) | MAPTHPGDKDM4EMEN1HCRTR1 |
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-2021230654-A1 | NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME | 주식회사 엘지화학 | 2021-11-18 | — | — | WO | disclosed |