Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.54 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.54 |
| ▸ | PRCP | P42785 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | HTR1A | P08908 | 2/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL12126117 | 0.90 | PRCP (0.55) | OPRM1OPRK1PRCPCYP2D6HTR1A | |
| SCHEMBL9541988 | 0.87 | OPRM1 (0.53) | OPRM1OPRK1PRCPCYP2D6HTR1A | |
| SCHEMBL12124978 | 0.85 | PRCP (0.56) | OPRM1OPRK1PRCPCYP2D6HTR1A | |
| SCHEMBL14417432 | 0.84 | OPRM1 (0.48) | OPRM1OPRK1PRCPCYP2D6SIGMAR1 | |
| SCHEMBL5527596 | 0.82 | OPRM1 (0.48) | OPRM1OPRK1PRCPCYP2D6HDAC3 | |
| SCHEMBL8820261 | 0.81 | OPRM1 (0.50) | OPRM1OPRK1PRCPSIGMAR1 | |
| SCHEMBL28851671 | 0.80 | CYP2D6 (0.47) | OPRM1OPRK1PRCPCYP2D6HTR1A | |
| SCHEMBL12125928 | 0.79 | PRCP (0.59) | OPRM1OPRK1PRCPHTR1A | |
| SCHEMBL3255532 | 0.79 | PRCP (0.54) | OPRM1OPRK1PRCP | |
| SCHEMBL4880438 | 0.77 | HCRTR1 (0.51) | OPRM1OPRK1HDAC3HDAC1HDAC2 |
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-117603139-A | Preparation method of 1- (hetero) aryl-2- (sulfonyl) -1,2,3,4 tetrahydroisoquinoline compound | 遵义医科大学 | 2024-02-27 | — | — | CN | disclosed |