Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 15/20 | 0.66 |
| ▸ | CNR2 | P34972 | 6/20 | 0.61 |
| ▸ | PDE4A | P27815 | 3/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.46 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.46 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.46 |
| ▸ | PRPS1 | P60891 | 1/20 | 0.45 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2644061 | 0.89 | CNR1 (0.64) | CNR1CNR2PDE4APDE4BPDE4C | |
| SCHEMBL2642840 | 0.88 | CNR1 (0.66) | CNR1CNR2PDE4APDE4BPDE4C | |
| SCHEMBL1107351 | 0.87 | CNR1 (0.62) | CNR1CNR2PDE4APDE4BPDE4C | |
| SCHEMBL2642626 | 0.86 | CNR1 (0.61) | CNR1CNR2PDE4APDE4BPDE4C | |
| SCHEMBL2642715 | 0.83 | CNR1 (0.61) | CNR1CNR2 | |
| SCHEMBL22450676 | 0.82 | CNR1 (0.55) | CNR1CNR2AVPR1A | |
| SCHEMBL5567261 | 0.82 | CNR1 (0.80) | CNR1CNR2AVPR1A | |
| SCHEMBL5562053 | 0.81 | CNR1 (0.98) | CNR1CNR2 | |
| SCHEMBL12480915 | 0.78 | PTGDR2 (0.52) | CNR1CNR2 | |
| SCHEMBL2078003 | 0.76 | CNR2 (1.00) | CNR1CNR2 |
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-2008005964-A2 | PHOSPHONATE AND PHOSPHINATE COMPOUNDS AS GLUCOKINASE ACTIVATORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-01-10 | — | — | WO | disclosed |