Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.67 |
| ▸ | MAPT | P10636 | 3/20 | 0.67 |
| ▸ | HTT | P42858 | 1/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.59 |
| ▸ | NPC1 | O15118 | 4/20 | 0.59 |
| ▸ | RAB9A | P51151 | 4/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.59 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.55 |
| ▸ | MEN1 | O00255 | 3/20 | 0.55 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.55 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.50 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL5856056 | 0.89 | ALDH1A1 (0.68) | ALDH1A1SMN1; SMN2NPC1RAB9AGAA | |
| SCHEMBL4693371 | 0.81 | ALDH1A1 (0.70) | ALDH1A1MAPTHTTSMN1; SMN2NPC1 | |
| SCHEMBL3201438 | 0.80 | ALDH1A1 (1.00) | ALDH1A1MAPTHTTSMN1; SMN2NPC1 | |
| SCHEMBL4754917 | 0.80 | ALDH1A1 (0.78) | ALDH1A1MAPTHTTSMN1; SMN2NPC1 | |
| SCHEMBL3729907 | 0.80 | NPC1 (0.75) | ALDH1A1MAPTHTTSMN1; SMN2NPC1 | |
| SCHEMBL3604393 | 0.79 | SMN1; SMN2 (0.68) | ALDH1A1MAPTHTTSMN1; SMN2NPC1 | |
| SCHEMBL3604397 | 0.79 | SMN1; SMN2 (0.68) | ALDH1A1MAPTHTTSMN1; SMN2NPC1 | |
| SCHEMBL5641504 | 0.79 | ADRB2 (0.68) | ALDH1A1MAPTHTTSMN1; SMN2NPC1 | |
| SCHEMBL24225548 | 0.78 | HPGD (0.71) | ALDH1A1SMN1; SMN2NPC1RAB9AGAA | |
| SCHEMBL22386732 | 0.77 | SMN1; SMN2 (0.69) | ALDH1A1MAPTHTTSMN1; SMN2NPC1 |
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-1521757-B1 | TRICYCLIC SPIROPIPERIDINES OR SPIROPYRROLIDINES | ASTRAZENECA AB (SE) | 2008-01-30 | — | — | EP | disclosed |