Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MMP7 | P09237 | 1/20 | 0.38 |
| ▸ | MMP10 | P09238 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28903712 | 0.89 | MAPT (0.42) | CA1CA2MEN1KMT2AMAPT | |
| SCHEMBL28489447 | 0.85 | MAPT (0.41) | MEN1KMT2AMAPTTSHRALDH1A1 | |
| SCHEMBL28903732 | 0.85 | MAPT (0.41) | MEN1KMT2AMAPTGAATSHR | |
| SCHEMBL28497517 | 0.82 | MAPT (0.49) | CA1CA2MEN1KMT2AMAPT | |
| SCHEMBL28497453 | 0.81 | CYP3A4 (0.43) | MEN1KMT2AMAPTGAAALDH1A1 | |
| SCHEMBL28489906 | 0.80 | ALDH1A1 (0.50) | MAPTTSHRALDH1A1 | |
| SCHEMBL28496770 | 0.75 | CYP3A4 (0.40) | MEN1KMT2AALDH1A1 | |
| SCHEMBL28498477 | 0.72 | CYP3A4 (0.43) | MEN1KMT2AALDH1A1 | |
| SCHEMBL28499811 | 0.72 | CYP3A4 (0.50) | MEN1KMT2AALOX15ALDH1A1 | |
| SCHEMBL28493442 | 0.70 | KMT2A (0.49) | MEN1KMT2AMAPTGAAALDH1A1 |
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 |