Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CRHBP | P24387 | 1/20 | 0.32 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.31 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.31 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.31 |
| ▸ | LTA4H | P09960 | 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 | |
|---|---|---|---|---|
| SCHEMBL15806857 | 0.87 | ALDH1A1 (0.38) | CASP3CASP7MAPK1PDK1ALDH1A1 | |
| SCHEMBL14376725 | 0.81 | ALDH1A1 (0.42) | CASP3CASP7ALDH1A1SMN1; SMN2TRPV6 | |
| SCHEMBL12464692 | 0.81 | ALDH1A1 (0.42) | CASP3CASP7ALDH1A1SMN1; SMN2TRPV6 | |
| SCHEMBL13407275 | 0.81 | ALDH1A1 (0.42) | CASP3CASP7ALDH1A1SMN1; SMN2TRPV6 | |
| SCHEMBL12353173 | 0.81 | MAPK1 (0.38) | MAPK1ALDH1A1CRHBPCRHR2SMN1; SMN2 | |
| SCHEMBL29306619 | 0.78 | TRPV6 (0.39) | CASP3CASP7TRPV6S1PR1S1PR3 | |
| SCHEMBL25962289 | 0.77 | CYP1A2 (0.48) | CYP1A2 | |
| SCHEMBL15806843 | 0.77 | CYP1A2 (0.48) | CYP1A2 | |
| SCHEMBL28706759 | 0.76 | ADRA1D (0.32) | ALDH1A1 | |
| SCHEMBL27896660 | 0.75 | S1PR1 (0.44) | ALDH1A1CYP1A2S1PR1S1PR3S1PR5 |
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-109478472-A | ELECTROLYTE FOR ELECTROCHEMICAL DEVICE, ELECTROLYTIC SOLUTION, AND ELECTROCHEMICAL DEVICE | 大塚化学株式会社 | 2019-03-15 | — | — | CN | disclosed |