Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 4/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.32 |
| ▸ | RXRA | P19793 | 2/20 | 0.32 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.31 |
| ▸ | FLT1 | P17948 | 1/20 | 0.30 |
| ▸ | KDR | P35968 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL681106 | 0.78 | HSP90AA1 (0.38) | KCNH3HSP90AA1PDE4AP2RX7NLRP3 | |
| SCHEMBL16402488 | 0.76 | NLRP3 (0.36) | KCNH3HSP90AA1PDE4AP2RX7NLRP3 | |
| SCHEMBL8513553 | 0.75 | NOS2 (0.38) | KCNH3HSP90AA1PDE4AP2RX7NLRP3 | |
| SCHEMBL22409600 | 0.75 | HSP90AA1 (0.40) | HSP90AA1PDE4AP2RX7 | |
| SCHEMBL24496491 | 0.75 | HSP90AA1 (0.35) | KCNH3HSP90AA1PDE4AGRIN1GRIN2B | |
| SCHEMBL19597662 | 0.75 | — | — | |
| SCHEMBL28025302 | 0.74 | KCNH3 (0.38) | KCNH3HSP90AA1GRIN1GRIN2BP2RX7 | |
| SCHEMBL30960194 | 0.74 | KCNH3 (0.38) | KCNH3HSP90AA1GRIN1GRIN2BP2RX7 | |
| SCHEMBL18652595 | 0.74 | PDE4A (0.36) | KCNH3HSP90AA1PDE4AP2RX7NLRP3 | |
| SCHEMBL28266382 | 0.74 | GRIN1 (0.37) | KCNH3HSP90AA1PDE4AGRIN1GRIN2B |
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 |
|---|---|---|---|---|---|---|---|
| CN-105473576-B | Pyrimidinedione compounds for cardiac disorders | 迈奥卡迪亚公司 | 2018-10-30 | — | — | CN | disclosed |