Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 5/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27699219 | 0.83 | ALDH1A1 (0.35) | ALDH1A1MAPTHPGDTSHR | |
| SCHEMBL27699407 | 0.72 | ALDH1A1 (0.33) | ALDH1A1HPGDTSHR | |
| SCHEMBL27719713 | 0.69 | ALDH1A1 (0.33) | ALDH1A1HPGDTSHR | |
| SCHEMBL27397703 | 0.69 | MEN1 (0.36) | ALDH1A1MAPTHPGDTSHR | |
| SCHEMBL27884257 | 0.67 | PTGDR2 (0.37) | GSK3BALDH1A1MAPTHPGDTSHR | |
| SCHEMBL27826062 | 0.63 | ALOX5 (0.36) | ALDH1A1HPGDTSHR | |
| SCHEMBL27719750 | 0.62 | ALDH1A1 (0.40) | ALDH1A1MAPTHPGD | |
| SCHEMBL28797225 | 0.62 | COMT (0.37) | ALDH1A1 | |
| SCHEMBL16556778 | 0.60 | ALDH1A1 (0.36) | ALDH1A1NPC1MAPTHTTRAB9A | |
| SCHEMBL9385618 | 0.59 | MAPT (0.36) | ALDH1A1NPC1MAPTRAB9ATSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-102648199-A | Piperidine compound and use thereof | ASTRAZENECA AB | 2012-08-22 | — | — | CN | disclosed |