Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 3/20 | 0.56 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.43 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.43 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.43 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28735380 | 1.00 | SCN9A (0.56) | SCN9AHDAC4HDAC6CYP1A2CYP2D6 | |
| SCHEMBL15844424 | 0.88 | SCN9A (0.69) | SCN9AHDAC4HDAC6CYP1A2CYP2D6 | |
| SCHEMBL15844259 | 0.88 | SCN9A (0.69) | SCN9AHDAC4HDAC6CYP1A2CYP2D6 | |
| SCHEMBL15844258 | 0.88 | SCN9A (0.69) | SCN9AHDAC4HDAC6CYP1A2CYP2D6 | |
| SCHEMBL28735306 | 0.81 | KCNH2 (0.48) | LMNAKCNH2POLBADRA1ANPSR1 | |
| SCHEMBL28735464 | 0.78 | KCNH2 (0.48) | LMNAKCNH2POLBSMN1; SMN2CACNA1I | |
| SCHEMBL28735428 | 0.78 | KCNH2 (0.48) | LMNAKCNH2POLBSMN1; SMN2CACNA1I | |
| SCHEMBL28939448 | 0.76 | KCNH2 (0.51) | KCNH2POLBADRA1ANPSR1CACNA1I | |
| SCHEMBL15244837 | 0.74 | SCN9A (0.94) | SCN9AHDAC4HDAC6CYP1A2CYP2D6 | |
| SCHEMBL16055793 | 0.74 | P2RX1 (0.47) | POLBCYP3A4SMN1; SMN2NPSR1 |
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-114478366-A | Pyridone derivative and application thereof in medicine | 海思科医药集团股份有限公司 | 2022-05-13 | — | — | CN | disclosed |