Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.54 |
| ▸ | HCRTR1 | O43613 | 4/20 | 0.53 |
| ▸ | HCRTR2 | O43614 | 4/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | MGLL | Q99685 | 1/20 | 0.51 |
| ▸ | TYR | P14679 | 1/20 | 0.50 |
| ▸ | CCR5 | P51681 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | DRD3 | P35462 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL30359060 | 0.84 | LMNA (0.50) | HTTMAPK14LMNAHSD11B1KMT2A | |
| SCHEMBL30359070 | 0.81 | HTT (0.55) | HTTCYP2C9CYP2C19MAPK14HCRTR1 | |
| SCHEMBL19766699 | 0.78 | HTT (0.90) | HTTCYP2C9CYP2C19MAPK14TSHR | |
| SCHEMBL11714770 | 0.78 | HTT (0.90) | HTTCYP2C9CYP2C19MAPK14TSHR | |
| SCHEMBL30359014 | 0.78 | MEN1 (0.52) | HTTCYP2C9CYP2C19MAPK14HCRTR1 | |
| SCHEMBL17502718 | 0.77 | HTT (0.62) | HTTCYP2C9CYP2C19MAPK14HCRTR1 | |
| SCHEMBL17502656 | 0.77 | HTT (0.62) | HTTCYP2C9CYP2C19MAPK14TSHR | |
| SCHEMBL1671929 | 0.77 | HCRTR1 (0.56) | HTTCYP2C9CYP2C19MAPK14HCRTR1 | |
| SCHEMBL30359043 | 0.76 | LMNA (0.48) | HTTCYP2C9CYP2C19MAPK14HCRTR1 | |
| SCHEMBL2540114 | 0.75 | HTT (0.90) | HTTCYP2C9CYP2C19MAPK14TSHR |
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-116057057-A | Conjugates of alpha 2-adrenoceptor subtype C (alpha-2C) antagonists and TASK1/3 channel blockers for the treatment of sleep apnea | 拜耳公司 | 2023-05-02 | — | — | CN | disclosed |