Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSD | P07339 | 3/20 | 0.36 |
| ▸ | BACE1 | P56817 | 3/20 | 0.36 |
| ▸ | BACE2 | Q9Y5Z0 | 3/20 | 0.36 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | LDHA | P00338 | 1/20 | 0.33 |
| ▸ | CALCA | P06881 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5224665 | 0.97 | PIK3C3 (0.37) | CTSDBACE1BACE2PIK3C3KDM4E | |
| SCHEMBL5224667 | 0.97 | PIK3C3 (0.37) | CTSDBACE1BACE2PIK3C3KDM4E | |
| SCHEMBL5219078 | 0.89 | PTGS2 (0.33) | KDM4ENPC1RAB9ASMN1; SMN2NPSR1 | |
| SCHEMBL5219097 | 0.89 | PTGS2 (0.33) | KDM4ENPC1RAB9ASMN1; SMN2NPSR1 | |
| SCHEMBL5219089 | 0.89 | PTGS2 (0.33) | KDM4ENPC1RAB9ASMN1; SMN2NPSR1 | |
| SCHEMBL5224678 | 0.85 | PTGS2 (0.34) | KDM4ENPC1RAB9ASMN1; SMN2NPSR1 | |
| SCHEMBL5224671 | 0.85 | PTGS2 (0.34) | KDM4ENPC1RAB9ASMN1; SMN2NPSR1 | |
| SCHEMBL5217755 | 0.83 | CTSD (0.37) | CTSDBACE1BACE2PIK3C3POLB | |
| SCHEMBL5223229 | 0.83 | KDM4E (0.41) | CTSDBACE1BACE2PIK3C3POLB | |
| SCHEMBL5221784 | 0.80 | CTSD (0.42) | CTSDBACE1BACE2PIK3C3POLB |
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 |