Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.44 |
| ▸ | PKM | P14618 | 4/20 | 0.44 |
| ▸ | HPGD | P15428 | 4/20 | 0.44 |
| ▸ | POLB | P06746 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | ALPG | P10696 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | NEK2 | P51955 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 5/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17604570 | 0.79 | MAPT (0.38) | KDM4EKMT2AHPGDMEN1SMN1; SMN2 | |
| SCHEMBL17604595 | 0.79 | PHF8 (0.48) | ALDH1A1KDM4EKMT2APKMHPGD | |
| SCHEMBL17604526 | 0.79 | PHF8 (0.48) | ALDH1A1KDM4EKMT2APKMHPGD | |
| SCHEMBL16095079 | 0.75 | ADORA2A (0.39) | KDM4EHPGDPOLBL3MBTL1MAPK1 | |
| SCHEMBL17604506 | 0.74 | KDM4C (0.54) | KDM4ESMN1; SMN2 | |
| SCHEMBL17604519 | 0.71 | KRAS (0.41) | KDM4EKMT2AL3MBTL1MAPTLMNA | |
| SCHEMBL16094975 | 0.71 | KDM4C (0.43) | ALDH1A1KDM4EPOLBMAPTLMNA | |
| SCHEMBL17604574 | 0.71 | PHF8 (0.37) | KMT2AMEN1MAPK1 | |
| SCHEMBL16095813 | 0.67 | PHF8 (0.39) | HPGDPOLBL3MBTL1MAPK1MAPT | |
| SCHEMBL29289242 | 0.66 | ALDH1A1 (0.65) | ALDH1A1KDM4EKMT2APKMHPGD |
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-3193881-A1 | HISTONE DEMETHYLASE INHIBITORS | Celgene Quanticel Research, Inc. (US) | 2017-07-26 | — | — | EP | disclosed |
| WO-2016044342-A1 | HISTONE DEMETHYLASE INHIBITORS | Quanticel Pharmaceuticals, Inc. (US) | 2016-03-24 | — | — | WO | disclosed |