Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 3/20 | 0.38 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.38 |
| ▸ | NPM1 | P06748 | 2/20 | 0.37 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.36 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.36 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29284763 | 0.89 | PTGES (0.36) | PDE2AGABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL29284761 | 0.86 | HSD17B10 (0.38) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL29284758 | 0.77 | PIK3CA (0.38) | ALKTLR7ATMKDM4E | |
| SCHEMBL29284762 | 0.72 | FGFR1 (0.47) | PDE2APDE10AGABRA1GABRG2GABRB3 | |
| SCHEMBL23119176 | 0.70 | NPM1 (0.47) | PDE2APDE10ANPM1ALKCASP3 | |
| SCHEMBL19960359 | 0.69 | PDE2A (0.43) | PDE2APDE10ANPM1ALKKMT2A | |
| SCHEMBL797783 | 0.69 | NPM1 (0.42) | PDE2APDE10ANPM1ALKLMNA | |
| SCHEMBL23119172 | 0.67 | NPM1 (0.43) | PDE2APDE10ANPM1ALKGABRG2 | |
| SCHEMBL19960362 | 0.66 | CYP1A2 (0.39) | PDE2APDE10ANPM1ALKKMT2A | |
| SCHEMBL20474245 | 0.66 | PRNP (0.45) | GABRA1GABRG2GABRB3GABRA5GABRA3 |
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-118221684-A | Method for preparing quinoxaline derivative through HFIP-promoted defluorination cyclization reaction of difluoro carbene reagent | 陕西科技大学 | 2024-06-21 | — | — | CN | disclosed |