Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNP | P00491 | 2/20 | 0.46 |
| ▸ | PDE5A | O76074 | 1/20 | 0.43 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.43 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.43 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.43 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3433603 | 0.88 | TSHR (0.52) | PNPPDE5AGRIA1GRIA2GRIA3 | |
| SCHEMBL3425179 | 0.86 | PNP (0.48) | PNPPDE5AGRIA1GRIA2GRIA3 | |
| SCHEMBL1533594 | 0.86 | PNP (0.44) | PNPPDE5AGRIA1GRIA2GRIA3 | |
| SCHEMBL5798037 | 0.86 | GRIA1 (0.45) | PNPPDE5AGRIA1GRIA2GRIA3 | |
| SCHEMBL2776930 | 0.84 | PNP (0.46) | PNPPDE5AGRIA1GRIA2GRIA3 | |
| SCHEMBL30080348 | 0.84 | PDE5A (0.43) | PNPPDE5AGRIA1GRIA2GRIA3 | |
| SCHEMBL30248422 | 0.82 | CYP1A2 (0.47) | PNPPDE5AGRIA1GRIA2GRIA3 | |
| SCHEMBL1286929 | 0.78 | PNP (0.50) | PNPPDE5AGRIA1GRIA2GRIA3 | |
| SCHEMBL29131184 | 0.77 | PNP (0.43) | PNPPDE5AGRIA1GRIA2GRIA3 | |
| SCHEMBL5084818 | 0.75 | PNP (0.58) | PNPPDE5AGRIA1GRIA2GRIA3 |
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-2001085221-A2 | ASSESSING LEVELS OF O6-ALKYLGUANINE-DNA ALKYLTRANSFERASE IN VIVO | DUKE UNIVERSITY (US) | 2001-11-15 | — | — | WO | disclosed |