Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2C | Q14957 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 11/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.34 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL13809226 | 0.85 | ABCG2 (0.39) | GRIN2CP2RX7ABCB1ABCG2 | |
| SCHEMBL13809253 | 0.82 | GRIN2C (0.43) | GRIN2CP2RX7ABCB1ABCG2 | |
| SCHEMBL13809228 | 0.80 | GRIN2C (0.43) | GRIN2CP2RX7ABCB1ABCG2 | |
| SCHEMBL13809007 | 0.79 | GRIN2C (0.43) | GRIN2CP2RX7ABCB1ABCG2 | |
| SCHEMBL13809241 | 0.76 | GRIN2C (0.41) | GRIN2CP2RX7ABCB1ABCG2 | |
| SCHEMBL13808739 | 0.76 | RORC (0.33) | — | |
| SCHEMBL13808741 | 0.74 | RORC (0.35) | — | |
| SCHEMBL13809234 | 0.73 | GRIN2C (0.40) | GRIN2CABCB1ABCG2 | |
| SCHEMBL13809244 | 0.72 | GRIN2C (0.36) | GRIN2C | |
| SCHEMBL13809251 | 0.66 | GRIN2C (0.49) | GRIN2C |
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-2009073545-A2 | TETRAHYDRO-ISOQUINOLINE PPAT INHIBITORS AS ANTIBACTERIAL AGENTS | MAXTHERA, INC. (US) | 2009-06-11 | — | — | WO | disclosed |