Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.35 |
| ▸ | PLAT | P00750 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | PRKCB | P05771 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.32 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.32 |
| ▸ | IDH1 | O75874 | 1/20 | 0.31 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.31 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.30 |
| ▸ | CDK9 | P50750 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | HTR2B | P41595 | 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 | |
|---|---|---|---|---|
| SCHEMBL30359028 | 0.82 | TRPV4 (0.41) | TRPV4 | |
| SCHEMBL30359182 | 0.76 | KCNK3 (0.44) | TRPV4GAAIDH1HTR2A | |
| SCHEMBL30359147 | 0.71 | ALDH1A1 (0.42) | TRPV4 | |
| SCHEMBL30359120 | 0.70 | TRPV4 (0.42) | TRPV4GAA | |
| SCHEMBL30359020 | 0.70 | TRPV4 (0.40) | TRPV4 | |
| SCHEMBL27588098 | 0.69 | CYP1A2 (0.39) | GAAUCHL1TRPA1CYP1A2CYP2D6 | |
| SCHEMBL313040 | 0.68 | CYP1A2 (0.38) | GAAUCHL1TRPA1CYP1A2CYP2D6 | |
| SCHEMBL10247168 | 0.68 | ALDH1A1 (0.39) | GAAUCHL1TRPA1CYP1A2CYP2D6 | |
| SCHEMBL313442 | 0.67 | CYP1A2 (0.38) | GAAUCHL1TRPA1CYP1A2CYP2D6 | |
| SCHEMBL2624132 | 0.67 | AURKA (0.39) | GAAUCHL1TRPA1CYP1A2CYP2D6 |
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 |