Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | PRKDC | P78527 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | ESR2 | Q92731 | 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 | |
|---|---|---|---|---|
| SCHEMBL19985954 | 0.95 | ALDH1A1 (0.31) | ALDH1A1KDM4EHPGDMAPTNPSR1 | |
| SCHEMBL17660970 | 0.95 | ALDH1A1 (0.32) | ALDH1A1KDM4EHPGDMAPTNPSR1 | |
| SCHEMBL22199911 | 0.94 | PRKDC (0.33) | ALDH1A1KDM4EHPGDMAPTNPSR1 | |
| SCHEMBL17661392 | 0.92 | ESR2 (0.32) | ALDH1A1KDM4EHPGDMAPTNPSR1 | |
| SCHEMBL17660901 | 0.92 | ESR2 (0.32) | ALDH1A1KDM4EHPGDMAPTNPSR1 | |
| SCHEMBL17660899 | 0.90 | ALDH1A1 (0.30) | ALDH1A1KDM4EHPGDMAPTNPSR1 | |
| SCHEMBL19985980 | 0.90 | KDM4E (0.31) | ALDH1A1KDM4EHPGDMAPTNPSR1 | |
| SCHEMBL17661476 | 0.89 | ESR2 (0.32) | ALDH1A1KDM4EHPGDMAPTNPSR1 | |
| SCHEMBL22012052 | 0.88 | — | — | |
| SCHEMBL22894027 | 0.88 | — | — |
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-2016052835-A1 | A PLURALITY OF HOST MATERIALS AND AN ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME | ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) | 2016-04-07 | — | — | WO | disclosed |