Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | TDO2 | P48775 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.34 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL576436 | 0.79 | IDO1 (0.50) | IDO1TDO2EPHX1CNR2HDAC4 | |
| SCHEMBL576210 | 0.72 | IDO1 (0.55) | IDO1TDO2EPHX1CNR2HDAC4 | |
| SCHEMBL31168142 | 0.69 | HTT (0.49) | HTTMAOBNFE2L2 | |
| SCHEMBL19503242 | 0.69 | HTT (0.49) | HTTMAOBNFE2L2 | |
| SCHEMBL29001727 | 0.69 | EPHX1 (0.44) | IDO1TDO2EPHX1CNR2HDAC4 | |
| SCHEMBL5723313 | 0.69 | PTGS1 (0.36) | EPHX1CES2CES1SLC6A2SLC6A4 | |
| SCHEMBL29519480 | 0.68 | ALOX5AP (0.47) | MAOBSLC6A2 | |
| SCHEMBL13006376 | 0.68 | ALOX5AP (0.47) | MAOBSLC6A2 | |
| SCHEMBL2389486 | 0.67 | MAOB (0.46) | HTTMAOB | |
| SCHEMBL29519490 | 0.67 | ADRA2A (0.45) | IDO1MAOB |
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-115911573-A | Nonaqueous electrolyte solution for secondary battery and nonaqueous electrolyte secondary battery using same | 三菱化学株式会社 | 2023-04-04 | — | — | CN | disclosed |