Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 5/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | BPTF | Q12830 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | MKNK1 | Q9BUB5 | 7/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.37 |
| ▸ | PRKCI | P41743 | 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 | |
|---|---|---|---|---|
| SCHEMBL17194353 | 0.79 | ADORA1 (0.50) | ADORA1MAPTKDM4EGAABPTF | |
| SCHEMBL20922384 | 0.78 | ADORA1 (0.55) | ADORA1MAPTKDM4EGAABPTF | |
| SCHEMBL17194169 | 0.77 | L3MBTL1 (0.52) | ADORA1MAPTKDM4EGAABPTF | |
| SCHEMBL17194311 | 0.76 | ADORA1 (0.55) | ADORA1MAPTKDM4EGAABPTF | |
| SCHEMBL17194176 | 0.76 | ADORA1 (0.55) | ADORA1MAPTKDM4EGAABPTF | |
| SCHEMBL2643671 | 0.76 | MAPT (0.73) | ADORA1MAPTKDM4EGAABPTF | |
| SCHEMBL17194374 | 0.75 | KDM4E (0.47) | ADORA1MAPTKDM4EGAABPTF | |
| SCHEMBL17194296 | 0.74 | ADORA1 (0.53) | ADORA1MAPTKDM4EGAABPTF | |
| SCHEMBL17194371 | 0.73 | MAPT (0.52) | ADORA1MAPTKDM4EGAABPTF | |
| SCHEMBL13739786 | 0.72 | MEN1 (0.55) | ADORA1MAPTKDM4EGAABPTF |
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-7517986-B2 | Tetrahydropyridothiophenes for use in the treatment of cancer | 4SC AG (DE) | 2009-04-14 | — | — | US | disclosed |