Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.38 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.32 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19105301 | 0.83 | TSHR (0.42) | TSHRMAPTCACNA1BAPBA1CYP3A4 | |
| SCHEMBL20954020 | 0.79 | TSHR (0.40) | TSHRMAPTCACNA1BAPBA1CYP3A4 | |
| SCHEMBL13347367 | 0.76 | GRIK1 (0.47) | MAPTGRIK1GRIK2 | |
| SCHEMBL4766772 | 0.76 | TSHR (0.42) | TSHRMAPTCACNA1BAPBA1CYP3A4 | |
| SCHEMBL7975200 | 0.74 | TSHR (0.41) | TSHRMAPTCACNA1BAPBA1CYP3A4 | |
| SCHEMBL28431074 | 0.74 | TSHR (0.37) | TSHRMAPTCACNA1BAPBA1CYP3A4 | |
| SCHEMBL8164447 | 0.74 | TSHR (0.42) | TSHRMAPTCACNA1BAPBA1CYP3A4 | |
| SCHEMBL28662748 | 0.73 | TSHR (0.47) | TSHRMAPTCACNA1BAPBA1CYP3A4 | |
| SCHEMBL32679948 | 0.73 | TSHR (0.43) | TSHRMAPTCACNA1BAPBA1CYP3A4 | |
| SCHEMBL770455 | 0.72 | TSHR (0.41) | TSHRMAPTCACNA1BAPBA1CYP3A4 |
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-107078352-B | Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery using same | 三菱化学株式会社 | 2020-04-28 | — | — | CN | disclosed |