Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | COXFA4 | O00483 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | CTSB | P07858 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | PKLR | P30613 | 1/20 | 0.38 |
| ▸ | MGAM | O43451 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | SI | P14410 | 3/20 | 0.38 |
| ▸ | MGAM2 | Q2M2H8 | 3/20 | 0.38 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.36 |
| ▸ | BRD1 | O95696 | 1/20 | 0.36 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 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 | |
|---|---|---|---|---|
| SCHEMBL2007338 | 1.00 | NPC1 (0.41) | NPC1MAPTRAB9ACOXFA4PKM | |
| SCHEMBL670625 | 0.80 | PKM (0.45) | NPC1MAPTRAB9ACOXFA4PKM | |
| SCHEMBL13423117 | 0.77 | COXFA4 (0.44) | NPC1MAPTRAB9ACOXFA4PKM | |
| SCHEMBL30513267 | 0.74 | AKT1 (0.56) | NPC1MAPTRAB9ACOXFA4PKM | |
| SCHEMBL3184205 | 0.74 | AKT1 (0.56) | NPC1MAPTRAB9ACOXFA4PKM | |
| SCHEMBL2451151 | 0.74 | ALDH1A1 (0.36) | MAPTPKMMEN1KMT2AALDH1A1 | |
| SCHEMBL2451149 | 0.74 | ALDH1A1 (0.36) | MAPTPKMMEN1KMT2AALDH1A1 | |
| SCHEMBL21430750 | 0.74 | MAPT (0.47) | NPC1MAPTRAB9ACOXFA4PKM | |
| SCHEMBL8243288 | 0.73 | DYRK1A (0.53) | RAB9AKDM4EALDH1A1L3MBTL1 | |
| SCHEMBL12402026 | 0.73 | DYRK1A (0.53) | RAB9AKDM4EALDH1A1L3MBTL1 |
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-7964624-B1 | Inhibitors of serine proteases | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2011-06-21 | — | — | US | disclosed |