Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.51 |
| ▸ | GAA | P10253 | 3/20 | 0.51 |
| ▸ | GLA | P06280 | 3/20 | 0.51 |
| ▸ | HPGD | P15428 | 5/20 | 0.50 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | GALR3 | O60755 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | GRM6 | O15303 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL20739845 | 0.88 | ALDH1A1 (0.49) | ALDH1A1KDM4EGAAGLAHPGD | |
| SCHEMBL27832590 | 0.87 | ALDH1A1 (0.51) | ALDH1A1KDM4EGAAGLAHPGD | |
| SCHEMBL19608810 | 0.83 | AR (0.53) | ALDH1A1KDM4EGAAHPGDMCL1 | |
| SCHEMBL19608809 | 0.83 | AR (0.53) | ALDH1A1KDM4EGAAHPGDMCL1 | |
| SCHEMBL22609642 | 0.80 | ALDH1A1 (0.52) | ALDH1A1KDM4EGAAGLAHPGD | |
| SCHEMBL19269894 | 0.80 | TSHR (0.37) | ALDH1A1KDM4EGAAGLAHPGD | |
| SCHEMBL2138267 | 0.79 | TSHR (0.54) | ALDH1A1KDM4EGAAGLAHPGD | |
| SCHEMBL16098270 | 0.78 | ALDH1A1 (0.50) | ALDH1A1KDM4EGAAGLAHPGD | |
| SCHEMBL18204411 | 0.78 | ALDH1A1 (0.50) | ALDH1A1KDM4EGAAGLAHPGD | |
| SCHEMBL16122648 | 0.77 | CYP11B1 (0.51) | ALDH1A1KDM4EGAAGLAHPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-20190051832-A1 | ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE THE SAME | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2019-02-14 | — | — | US | disclosed |