Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.51 |
| ▸ | RAB9A | P51151 | 5/20 | 0.51 |
| ▸ | HPGD | P15428 | 4/20 | 0.49 |
| ▸ | TSHR | P16473 | 3/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | CTSD | P07339 | 4/20 | 0.45 |
| ▸ | BACE1 | P56817 | 4/20 | 0.45 |
| ▸ | BACE2 | Q9Y5Z0 | 4/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5224335 | 0.99 | NPC1 (0.53) | NPC1SMN1; SMN2RAB9AHPGDTSHR | |
| SCHEMBL5223517 | 0.89 | NPC1 (0.54) | NPC1SMN1; SMN2RAB9AHPGDTSHR | |
| SCHEMBL5221612 | 0.88 | NPC1 (0.56) | NPC1SMN1; SMN2RAB9AHPGDTSHR | |
| SCHEMBL5219444 | 0.83 | MEN1 (0.56) | NPC1SMN1; SMN2RAB9AHPGDTSHR | |
| SCHEMBL475775 | 0.83 | MEN1 (0.56) | NPC1SMN1; SMN2RAB9AHPGDTSHR | |
| SCHEMBL5222325 | 0.81 | GAA (0.50) | NPC1SMN1; SMN2RAB9AHPGDTSHR | |
| SCHEMBL5222197 | 0.81 | GAA (0.63) | NPC1SMN1; SMN2RAB9AHPGDTSHR | |
| SCHEMBL5223014 | 0.81 | CTSD (0.48) | NPC1SMN1; SMN2RAB9AHPGDTSHR | |
| SCHEMBL5249254 | 0.81 | NPC1 (0.47) | NPC1SMN1; SMN2RAB9AHPGDTSHR | |
| SCHEMBL5249518 | 0.80 | SMN1; SMN2 (0.49) | NPC1SMN1; SMN2RAB9AHPGDTSHR |
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-1567488-B1 | HYDROXYETHYLAMINE DERIVATIVES FOR THE TREATMENT OF ALZHEIMER'S DISEASE | GLAXO GROUP LTD (GB) | 2007-02-21 | — | — | EP | disclosed |