Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 16/20 | 0.54 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.36 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.36 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL13306567 | 1.00 | P2RX7 (0.54) | P2RX7HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL2103656 | 1.00 | P2RX7 (0.54) | P2RX7HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL2100578 | 0.92 | P2RX7 (0.55) | P2RX7HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL2099737 | 0.91 | P2RX7 (0.57) | P2RX7HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL2609189 | 0.91 | P2RX7 (0.55) | P2RX7HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL2102565 | 0.91 | P2RX7 (0.55) | P2RX7HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL2101486 | 0.87 | P2RX7 (0.67) | P2RX7HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL2100101 | 0.87 | P2RX7 (0.67) | P2RX7HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL2103964 | 0.87 | P2RX7 (0.57) | P2RX7HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL2103966 | 0.87 | P2RX7 (0.57) | P2RX7HDAC3HDAC4HDAC1HDAC7 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8163929-B2 | Dihydropyridone amides as P2X7 modulators | ROCHE PALO ALTO LLC (US) | 2012-04-24 | — | — | US | disclosed |
| US-8163929-B2 | Dihydropyridone amides as P2X7 modulators | ROCHE PALO ALTO LLC (US) | 2012-04-24 | — | — | US | disclosed |
| WO-2010072607-A1 | DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-07-01 | — | — | WO | disclosed |