Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | GFER | P55789 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28493442 | 0.88 | KMT2A (0.49) | KMT2AMEN1GAAHPGDALDH1A1 | |
| SCHEMBL28497517 | 0.87 | MAPT (0.49) | KMT2AMEN1GAAHPGDCA1 | |
| SCHEMBL28498697 | 0.85 | KMT2A (0.44) | PKMKMT2AMEN1GAAHPGD | |
| SCHEMBL28487989 | 0.85 | MAPT (0.54) | KMT2AMEN1GAAHPGDALDH1A1 | |
| SCHEMBL28903712 | 0.81 | MAPT (0.42) | PKMKMT2AMEN1GAAHPGD | |
| SCHEMBL28498454 | 0.80 | MAPT (0.43) | KMT2AMEN1GAAHPGD | |
| SCHEMBL2838161 | 0.74 | MAPT (0.61) | TSHR | |
| SCHEMBL28497471 | 0.74 | ALDH1A1 (0.59) | PKMKMT2AALDH1A1TSHRMAPK1 | |
| SCHEMBL29095265 | 0.72 | HPGD (0.49) | KMT2AMEN1GAAHPGD | |
| SCHEMBL28489904 | 0.71 | TAAR1 (0.49) | PKMKMT2AMEN1ALDH1A1TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112110932-B | Method for synthesizing phthalide tetrahydroisoquinoline compound by tandem cyclization strategy | 沈阳药科大学 | 2021-12-28 | — | — | CN | disclosed |
| CN-112110932-A | Method for synthesizing phthalide tetrahydroisoquinoline compound by tandem cyclization strategy | 沈阳药科大学 | 2020-12-22 | — | — | CN | disclosed |