Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.59 |
| ▸ | PKM | P14618 | 2/20 | 0.59 |
| ▸ | GAA | P10253 | 1/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.59 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | PARP1 | P09874 | 1/20 | 0.50 |
| ▸ | PRMT5 | O14744 | 4/20 | 0.48 |
| ▸ | WDR77 | Q9BQA1 | 4/20 | 0.48 |
| ▸ | NAMPT | P43490 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1018352 | 0.97 | HRH3 (0.60) | ALDH1A1PKMGAAHSD17B10HRH3 | |
| SCHEMBL1016821 | 0.87 | ALDH1A1 (0.45) | ALDH1A1PKMGAAHSD17B10HRH3 | |
| SCHEMBL1016153 | 0.87 | ALDH1A1 (0.48) | ALDH1A1PKMGAAHSD17B10HRH3 | |
| SCHEMBL1014872 | 0.85 | NAMPT (0.49) | ALDH1A1PKMGAAHSD17B10HRH3 | |
| SCHEMBL1017287 | 0.85 | FAAH (0.44) | ALDH1A1PKMGAAHSD17B10HRH3 | |
| SCHEMBL5411176 | 0.85 | ALDH1A1 (0.43) | ALDH1A1PKMGAAHSD17B10HRH3 | |
| SCHEMBL1014859 | 0.84 | KDM4E (0.50) | ALDH1A1PKMGAAHSD17B10HRH3 | |
| SCHEMBL1019875 | 0.84 | ALDH1A1 (0.44) | ALDH1A1PKMGAAHSD17B10HRH3 | |
| SCHEMBL1018194 | 0.84 | ALDH1A1 (0.45) | ALDH1A1PKMGAAHSD17B10HRH3 | |
| SCHEMBL1016631 | 0.84 | ALDH1A1 (0.45) | ALDH1A1PKMGAAHSD17B10HRH3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1998620-B1 | PIPERAZINYL OXOALKYL TETRAHYDROISOQUINOLINES AND RELATED ANALOGUES | NEUROGEN CORP (US) | 2011-01-12 | — | — | EP | disclosed |