Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.45 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.45 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.43 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.43 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.43 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.43 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.42 |
| ▸ | JAK2 | O60674 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 2/20 | 0.41 |
| ▸ | CYP46A1 | Q9Y6A2 | 2/20 | 0.41 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.41 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.41 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.41 |
| ▸ | GRM5 | P41594 | 1/20 | 0.41 |
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.38 |
| ▸ | CDC7 | O00311 | 1/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.37 |
| ▸ | PLK4 | O00444 | 1/20 | 0.37 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL25421476 | 0.90 | BCAT2 (0.51) | KEAP1NFE2L2CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL16654579 | 0.87 | BCAT2 (0.53) | KEAP1NFE2L2CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL7098623 | 0.86 | IKBKB (0.43) | KEAP1NFE2L2CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL31329756 | 0.85 | CHRNB2 (0.41) | KEAP1NFE2L2CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL7098629 | 0.84 | PARP1 (0.42) | KEAP1NFE2L2CHRNB2CHRNB4CHRNA3 | |
| Hydrochloric Acid SCHEMBL30692651 | 0.84 | BCAT2 (0.50) | KEAP1NFE2L2CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL21381430 | 0.81 | JAK2 (0.41) | KEAP1NFE2L2CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL21629952 | 0.81 | SYK (0.39) | CHRNB2CHRNB4CHRNA3CHRNA4BCAT2 | |
| SCHEMBL30882864 | 0.81 | JAK2 (0.41) | KEAP1NFE2L2CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL21381429 | 0.80 | JAK2 (0.41) | KEAP1NFE2L2JAK2PARP1AURKA |
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-117120429-A | KHK inhibitor | 吉利德科学公司 | 2023-11-24 | — | — | CN | disclosed |