Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P4HB | P07237 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 4/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | AURKA | O14965 | 1/20 | 0.34 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.34 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.34 |
| ▸ | CD38 | P28907 | 2/20 | 0.34 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14983819 | 0.84 | GABRA1 (0.47) | IRAK4PARP1HTTAURKAPDPK1 | |
| SCHEMBL30726149 | 0.84 | P4HB (0.47) | P4HBHTR2AHTR2CHTR2BIRAK4 | |
| SCHEMBL30726153 | 0.79 | PARP14 (0.37) | P4HBHTR2APARP1MEN1KMT2A | |
| SCHEMBL6216947 | 0.77 | PARP1 (0.50) | HTR2BPARP1AURKAPDPK1RPS6KB1 | |
| Ammonia Solution, Strong SCHEMBL27338721 | 0.76 | PARP1 (0.49) | HTR2BPARP1AURKAPDPK1RPS6KB1 | |
| SCHEMBL4343547 | 0.76 | TAAR1 (0.49) | HTR2AHTR2CHTR2BPARP1AURKA | |
| SCHEMBL27323217 | 0.74 | P4HB (0.49) | P4HBHTR2AHTR2CHTR2B | |
| SCHEMBL2886555 | 0.74 | PARP1 (0.44) | PARP1AURKAPDPK1RPS6KB1CD38 | |
| SCHEMBL31329867 | 0.73 | PARP1 (0.43) | HTR2BPARP1HTTAURKAPDPK1 | |
| SCHEMBL21632383 | 0.73 | PARP1 (0.43) | HTR2BPARP1HTTAURKAPDPK1 |
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-117425644-A | Opioid receptor modulators | 埃皮欧黛公司 | 2024-01-19 | — | — | CN | disclosed |