Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.44 |
| ▸ | CNR2 | P34972 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 2/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.43 |
| ▸ | DRD3 | P35462 | 2/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1691958 | 0.98 | KCNH2 (0.53) | KCNH2SIGMAR1CNR2DRD2OPRM1 | |
| SCHEMBL18597659 | 0.98 | KCNH2 (0.53) | KCNH2SIGMAR1CNR2DRD2OPRM1 | |
| Hydrochloric Acid SCHEMBL28371828 | 0.96 | KCNH2 (0.51) | KCNH2SIGMAR1CNR2DRD2OPRM1 | |
| SCHEMBL28028325 | 0.94 | TDP1 (0.46) | KCNH2SIGMAR1ALDH1A1TSHRDRD2 | |
| Hydrochloric Acid SCHEMBL6640845 | 0.84 | TSHR (0.48) | SIGMAR1CNR2ALDH1A1TSHR | |
| SCHEMBL9013394 | 0.81 | KCNH2 (0.70) | KCNH2SIGMAR1DRD2OPRM1DRD3 | |
| SCHEMBL22870759 | 0.80 | KCNH2 (0.62) | KCNH2DRD2OPRM1DRD3OPRD1 | |
| SCHEMBL9484533 | 0.80 | KCNH2 (0.62) | KCNH2DRD2OPRM1DRD3OPRD1 | |
| SCHEMBL10938303 | 0.80 | SIGMAR1 (0.37) | KCNH2SIGMAR1CNR2ALDH1A1TSHR | |
| SCHEMBL16687557 | 0.80 | RARB (0.54) | CNR2ALDH1A1TSHR |
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-104969406-B | Electrolyte solution for electrochemical device and electrochemical device | 富士胶片和光纯药株式会社 | 2018-11-02 | — | — | CN | disclosed |