Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 2/20 | 0.66 |
| ▸ | ACHE | P22303 | 1/20 | 0.60 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.57 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL10464185 | 0.82 | CXCR4 (0.60) | CXCR4ACHEKCNH2CACNA1G | |
| SCHEMBL10759534 | 0.82 | PRMT6 (0.62) | CXCR4ACHEKCNH2 | |
| SCHEMBL8707233 | 0.80 | CXCR4 (1.00) | CXCR4ACHE | |
| SCHEMBL5723679 | 0.80 | CXCR4 (0.68) | CXCR4ACHE | |
| SCHEMBL8186709 | 0.79 | ACHE (0.66) | CXCR4ACHE | |
| SCHEMBL5909549 | 0.79 | ACHE (0.67) | ACHE | |
| SCHEMBL8406869 | 0.79 | CXCR4 (0.75) | CXCR4ACHE | |
| SCHEMBL18105312 | 0.78 | CXCR4 (0.66) | CXCR4ACHE | |
| SCHEMBL5724636 | 0.78 | CXCR4 (0.66) | CXCR4ACHE | |
| SCHEMBL5234223 | 0.78 | ACHE (0.56) | CXCR4ACHEKCNH2 |
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-2009071707-A1 | NOVEL COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES | GALAPAGOS NV (BE) | 2009-06-11 | — | — | WO | disclosed |