Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 14/20 | 0.62 |
| ▸ | FDPS | P14324 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.61 |
| ▸ | MAPT | P10636 | 5/20 | 0.59 |
| ▸ | HTT | P42858 | 2/20 | 0.59 |
| ▸ | NPC1 | O15118 | 2/20 | 0.59 |
| ▸ | RAB9A | P51151 | 2/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | TTR | P02766 | 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 | |
|---|---|---|---|---|
| SCHEMBL6685562 | 0.91 | ALDH1A1 (0.57) | ALDH1A1FDPSSMN1; SMN2MAPTHTT | |
| SCHEMBL5096223 | 0.85 | ALDH1A1 (0.72) | ALDH1A1FDPSSMN1; SMN2MAPTHTT | |
| SCHEMBL6239908 | 0.82 | SMN1; SMN2 (0.53) | ALDH1A1SMN1; SMN2MAPTHTTNPC1 | |
| SCHEMBL6702861 | 0.82 | ALDH1A1 (0.49) | ALDH1A1FDPSSMN1; SMN2MAPTHTT | |
| SCHEMBL20463442 | 0.81 | ALDH1A1 (0.73) | ALDH1A1FDPSSMN1; SMN2MAPTHTT | |
| SCHEMBL12259154 | 0.80 | ALDH1A1 (0.70) | ALDH1A1FDPSSMN1; SMN2MAPTHTT | |
| SCHEMBL1353565 | 0.79 | ALDH1A1 (0.64) | ALDH1A1FDPSSMN1; SMN2MAPTHTT | |
| SCHEMBL25273898 | 0.79 | FDPS (0.77) | ALDH1A1FDPSSMN1; SMN2MAPTHTT | |
| SCHEMBL14078205 | 0.78 | ALDH1A1 (0.74) | ALDH1A1FDPSSMN1; SMN2MAPTHTT | |
| SCHEMBL8807187 | 0.78 | GAA (0.55) | ALDH1A1SMN1; SMN2MAPTHTTTSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005000309-A2 | CHEMICAL COMPOUNDS | IONIX PHARMACEUTICALS LIMITED (GB) | 2005-01-06 | — | — | WO | disclosed |
| WO-2004087125-A1 | AMINO ACID DERIVATIVES AS INHIBITORS OF MAMMALIAN SODIUM CHANNELS | IONIX PHARMACEUTICALS LIMITED (GB) | 2004-10-14 | — | — | WO | disclosed |