Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.38 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.38 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.38 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | PDE5A | O76074 | 4/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13329839 | 0.89 | KDM4E (0.44) | ALDH1A1KDM4ENPSR1MAPTGAA | |
| SCHEMBL13329913 | 0.89 | ALDH1A1 (0.48) | ALDH1A1KDM4ENPSR1MAPTGAA | |
| SCHEMBL13330000 | 0.89 | PDE5A (0.36) | ALDH1A1KDM4EMAPTHPGDL3MBTL1 | |
| SCHEMBL13329799 | 0.88 | ACVR1 (0.40) | ALDH1A1KDM4ENPSR1MAPTGAA | |
| SCHEMBL13329986 | 0.85 | ALDH1A1 (0.42) | ALDH1A1KDM4ENPSR1MAPTGAA | |
| SCHEMBL13330056 | 0.84 | ALDH1A1 (0.38) | ALDH1A1KDM4ENPSR1MAPTGAA | |
| SCHEMBL13329825 | 0.83 | KDM4E (0.38) | ALDH1A1KDM4ENPSR1MAPTGAA | |
| SCHEMBL13330228 | 0.80 | ACVR1 (0.38) | ALDH1A1KDM4ENPSR1MAPTHPGD | |
| SCHEMBL13329850 | 0.80 | CDC7 (0.55) | ALDH1A1KDM4ENPSR1MAPTGAA | |
| SCHEMBL13330055 | 0.78 | RAB9A (0.41) | ALDH1A1KDM4EMAPTGAAHPGD |
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-2010067123-A1 | 2- (PIPERIDIN-1-YL) -4-HETEROCYCLYL-THIAZOLE-5-CARBOXYLIC ACID DERIVATIVES AGAINST BACTERIAL INFECTIONS | ASTRAZENECA AB (SE) | 2010-06-17 | — | — | WO | disclosed |