Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.42 |
| ▸ | MAPT | P10636 | 5/20 | 0.42 |
| ▸ | HPGD | P15428 | 5/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | FDPS | P14324 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13086356 | 0.91 | ALDH1A1 (0.41) | ALDH1A1MAPTHPGDSMN1; SMN2CYP2C9 | |
| SCHEMBL13086368 | 0.89 | ALDH1A1 (0.41) | ALDH1A1MAPTHPGDSMN1; SMN2CYP2C9 | |
| SCHEMBL13086318 | 0.85 | ALDH1A1 (0.40) | ALDH1A1MAPTHPGDSMN1; SMN2CYP2C9 | |
| SCHEMBL13086364 | 0.85 | HPGD (0.40) | ALDH1A1MAPTHPGDSMN1; SMN2RAB9A | |
| SCHEMBL13085814 | 0.83 | EPHX2 (0.39) | ALDH1A1MAPTHPGDSMN1; SMN2CYP2C9 | |
| SCHEMBL18544318 | 0.77 | ALDH1A1 (0.50) | ALDH1A1MAPTHPGDSMN1; SMN2CYP2C9 | |
| SCHEMBL13086523 | 0.77 | ALDH1A1 (0.41) | ALDH1A1MAPTHPGDSMN1; SMN2CYP2C9 | |
| SCHEMBL2779229 | 0.76 | MAPT (0.41) | ALDH1A1MAPTHPGDSMN1; SMN2CYP2C9 | |
| SCHEMBL13086256 | 0.75 | ALDH1A1 (0.42) | ALDH1A1MAPTHPGDSMN1; SMN2CYP2C9 | |
| SCHEMBL13086347 | 0.74 | CYP2C9 (0.32) | ALDH1A1MAPTHPGDSMN1; SMN2CYP2C9 |
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-2010118968-A1 | NO-DONOR ASPIRIN DERIVATIVES | NICOX S.A. (FR) | 2010-10-21 | — | — | WO | disclosed |