Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.33 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.32 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.32 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.30 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.30 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.30 |
| ▸ | PDE9A | O76083 | 1/20 | 0.30 |
| ▸ | PDE1A | P54750 | 1/20 | 0.30 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.30 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29126006 | 0.90 | TSHR (0.47) | TSHRMAPTL3MBTL1NPSR1CYP2D6 | |
| SCHEMBL29128452 | 0.80 | CYP2D6 (0.35) | TSHRMAPTL3MBTL1NPSR1CYP2D6 | |
| SCHEMBL29125877 | 0.80 | NPC1 (0.42) | TSHRMAPTL3MBTL1NPSR1NPC1 | |
| SCHEMBL29128515 | 0.77 | CYP2D6 (0.36) | TSHRMAPTL3MBTL1NPSR1CYP2D6 | |
| SCHEMBL29125971 | 0.76 | NISCH (0.48) | TSHRMAPTL3MBTL1NPSR1NISCH | |
| SCHEMBL29125806 | 0.71 | NPC1 (0.42) | TSHRMAPTHSD17B10NPC1RAB9A | |
| SCHEMBL29125703 | 0.69 | TSHR (0.37) | TSHRCYP2D6CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL29125736 | 0.68 | ALDH1A1 (0.38) | TSHRMAPTL3MBTL1HPGDHSD17B10 | |
| SCHEMBL29125715 | 0.67 | ADRA2A (0.36) | TSHRADRA2AADRA2BADRA2C | |
| SCHEMBL29125830 | 0.64 | NISCH (0.49) | TSHRMAPTL3MBTL1NPSR1NISCH |
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-117247361-A | Phenol-oxazolone/thioketone compound and synthetic method and application thereof | 吉首大学 | 2023-12-19 | — | — | CN | disclosed |