Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.66 |
| ▸ | PKM | P14618 | 1/20 | 0.63 |
| ▸ | CA12 | O43570 | 1/20 | 0.62 |
| ▸ | CA9 | Q16790 | 1/20 | 0.62 |
| ▸ | ESR1 | P03372 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.53 |
| ▸ | CNR2 | P34972 | 4/20 | 0.50 |
| ▸ | CNR1 | P21554 | 3/20 | 0.50 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.47 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.47 |
| ▸ | PTPRC | P08575 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL3702995 | 0.98 | ALDH1A1 (0.63) | ALDH1A1PKMCA12CA9ESR1 | |
| SCHEMBL3697451 | 0.94 | PKM (0.71) | ALDH1A1PKMCA12CA9ESR1 | |
| SCHEMBL3886338 | 0.88 | ALDH1A1 (0.62) | ALDH1A1PKMCA12CA9ESR1 | |
| SCHEMBL3701001 | 0.88 | MAPT (0.67) | ALDH1A1PKMCA12CA9ESR1 | |
| SCHEMBL812682 | 0.88 | PKM (0.79) | ALDH1A1PKMCA12CA9ESR1 | |
| SCHEMBL6158839 | 0.85 | ALDH1A1 (0.59) | ALDH1A1PKMCA12CA9ESR1 | |
| SCHEMBL8656925 | 0.85 | PKM (0.63) | ALDH1A1PKMCA12CA9ESR1 | |
| SCHEMBL6158969 | 0.84 | ALDH1A1 (0.58) | ALDH1A1PKMCA12CA9ESR1 | |
| SCHEMBL28380035 | 0.84 | NPSR1 (0.69) | ALDH1A1PKMCA12CA9ESR1 | |
| SCHEMBL6158520 | 0.84 | ALDH1A1 (0.61) | ALDH1A1PKMCA12CA9ESR1 |
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-109641472-B | Recording material and recording sheet | 日本曹达株式会社 | 2021-07-27 | — | — | CN | disclosed |