Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCAT2 | O15382 | 1/20 | 0.50 |
| ▸ | PARP1 | P09874 | 3/20 | 0.46 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.41 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.38 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.38 |
| ▸ | IKBKB | O14920 | 2/20 | 0.38 |
| ▸ | GRK6 | P43250 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.36 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.36 |
| ▸ | HNF4A | P41235 | 1/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.35 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.35 |
| ▸ | FEN1 | P39748 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8102370 | 0.86 | BCAT2 (0.69) | BCAT2PARP1KEAP1NFE2L2IKBKB | |
| SCHEMBL28053360 | 0.85 | BCAT2 (0.49) | BCAT2KEAP1NFE2L2IKBKBKDM4E | |
| SCHEMBL3791160 | 0.82 | BCAT2 (0.53) | BCAT2PARP1KEAP1NFE2L2MKNK1 | |
| SCHEMBL1982663 | 0.82 | BCAT2 (0.74) | BCAT2PARP1KEAP1NFE2L2MKNK1 | |
| SCHEMBL27895562 | 0.81 | BCAT2 (0.52) | BCAT2PARP1KEAP1NFE2L2MKNK1 | |
| SCHEMBL17143067 | 0.79 | BCAT2 (0.50) | BCAT2PARP1KEAP1NFE2L2MKNK1 | |
| SCHEMBL27895561 | 0.78 | BCAT2 (0.53) | BCAT2PARP1KEAP1NFE2L2MKNK1 | |
| SCHEMBL30029239 | 0.78 | EIF4E (0.46) | BCAT2PARP1KEAP1NFE2L2MKNK1 | |
| SCHEMBL27486058 | 0.77 | KDM4E (0.52) | BCAT2PARP1KEAP1NFE2L2KDM4E | |
| SCHEMBL31682597 | 0.76 | BCAT2 (0.44) | BCAT2PARP1IKBKBGRK6KDM4E |
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-113831302-B | Benzisoselenazolone derivative and preparation method and application thereof | 山东大学 | 2022-11-29 | — | — | CN | disclosed |