Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRCP | P42785 | 2/20 | 0.67 |
| ▸ | DRD1 | P21728 | 5/20 | 0.64 |
| ▸ | DRD2 | P14416 | 3/20 | 0.64 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | THPO | P40225 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | MTOR | P42345 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29783565 | 1.00 | PRCP (0.67) | PRCPDRD1DRD2TRPV1CA1 | |
| SCHEMBL21444628 | 0.83 | DRD1 (0.80) | PRCPDRD1DRD2MAPK1THPO | |
| SCHEMBL7596672 | 0.83 | PRCP (0.69) | PRCPDRD1DRD2 | |
| SCHEMBL8277195 | 0.81 | TRPV1 (0.68) | PRCPDRD1DRD2TRPV1CA1 | |
| SCHEMBL25604565 | 0.80 | PRCP (1.00) | PRCPDRD1DRD2 | |
| SCHEMBL8415128 | 0.80 | PRCP (1.00) | PRCPDRD1DRD2 | |
| SCHEMBL13928812 | 0.80 | PRCP (1.00) | PRCPDRD1DRD2 | |
| SCHEMBL7653569 | 0.79 | PRCP (0.68) | PRCPDRD1DRD2CA1CA2 | |
| Iodide SCHEMBL27518895 | 0.79 | PRCP (0.97) | PRCPDRD1DRD2 | |
| SCHEMBL29783557 | 0.77 | PRCP (0.64) | PRCPDRD1DRD2CA1CA2 |
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-114516835-B | Synthesis method of alpha, alpha-disubstituted tetrahydroisoquinoline compound | 西安石油大学 | 2023-08-15 | — | — | CN | disclosed |
| CN-114516835-A | Synthetic method of alpha, alpha-disubstituted tetrahydroisoquinoline compounds | 西安石油大学 | 2022-05-20 | — | — | CN | disclosed |