Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19974365 | 1.00 | ALDH1A1 (0.36) | ALDH1A1NPC1RAB9AHTTSLC18A3 | |
| SCHEMBL19974368 | 0.89 | KDM4E (0.31) | HTTSLC18A3ADRA1A | |
| SCHEMBL19974370 | 0.89 | KDM4E (0.31) | HTTSLC18A3ADRA1A | |
| SCHEMBL25200342 | 0.85 | SIGMAR1 (0.46) | ALDH1A1 | |
| SCHEMBL30408574 | 0.85 | SIGMAR1 (0.46) | ALDH1A1 | |
| SCHEMBL19987321 | 0.83 | L3MBTL1 (0.39) | ALDH1A1RAB9A | |
| SCHEMBL29882047 | 0.83 | L3MBTL1 (0.39) | ALDH1A1RAB9A | |
| SCHEMBL30409214 | 0.78 | NPC1 (0.43) | ALDH1A1NPC1RAB9A | |
| SCHEMBL25418356 | 0.78 | NPC1 (0.43) | ALDH1A1NPC1RAB9A | |
| SCHEMBL1101217 | 0.77 | CYP2A6 (0.43) | ALDH1A1SLC18A3ADRA1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018049535-A1 | NUCLEOSIDE ANALOGUES AND METHODS OF USE THEREOF | LCB PHARMA INC. (CA) | 2018-03-22 | — | — | WO | disclosed |