Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSD | P07339 | 2/20 | 0.38 |
| ▸ | BACE1 | P56817 | 2/20 | 0.38 |
| ▸ | BACE2 | Q9Y5Z0 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.33 |
| ▸ | CTSS | P25774 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | NAMPT | P43490 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.31 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.31 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.31 |
| ▸ | PSMB2 | P49721 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5223196 | 1.00 | CTSD (0.38) | CTSDBACE1BACE2NPC1RAB9A | |
| SCHEMBL5223660 | 0.82 | RAB9A (0.38) | CTSDBACE1BACE2NPC1RAB9A | |
| SCHEMBL5223654 | 0.82 | RAB9A (0.38) | CTSDBACE1BACE2NPC1RAB9A | |
| SCHEMBL5221262 | 0.79 | USP2 (0.46) | CTSDBACE1BACE2ALDH1A1TSHR | |
| SCHEMBL5221255 | 0.79 | USP2 (0.46) | CTSDBACE1BACE2ALDH1A1TSHR | |
| SCHEMBL5226207 | 0.78 | CTSD (0.38) | CTSDBACE1BACE2CTSSCTSK | |
| SCHEMBL5226201 | 0.78 | CTSD (0.38) | CTSDBACE1BACE2CTSSCTSK | |
| SCHEMBL5224505 | 0.76 | CTSD (0.34) | CTSDBACE1BACE2NAMPT | |
| SCHEMBL5224498 | 0.76 | CTSD (0.34) | CTSDBACE1BACE2NAMPT | |
| Hydrochloric Acid SCHEMBL5221991 | 0.76 | NPC1 (0.35) | CTSDBACE1BACE2NPC1RAB9A |
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 |