Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCAT2 | O15382 | 1/20 | 0.61 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.50 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.49 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.45 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.45 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.45 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.45 |
| ▸ | FEN1 | P39748 | 1/20 | 0.45 |
| ▸ | AR | P10275 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.43 |
| ▸ | IKBKB | O14920 | 1/20 | 0.43 |
| ▸ | CHUK | O15111 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL4243215 | 0.98 | BCAT2 (0.63) | BCAT2PDK2PKN1PKN2NPC1 | |
| SCHEMBL29131435 | 0.89 | BCAT2 (0.53) | BCAT2PDK2PKN1PKN2NPC1 | |
| SCHEMBL31227976 | 0.82 | BCAT2 (0.67) | BCAT2PKN1PKN2PARP1MKNK1 | |
| SCHEMBL167082 | 0.82 | BCAT2 (0.67) | BCAT2PKN1PKN2PARP1MKNK1 | |
| SCHEMBL30514275 | 0.82 | BCAT2 (0.67) | BCAT2PKN1PKN2PARP1MKNK1 | |
| SCHEMBL13734618 | 0.81 | ERN1 (0.51) | BCAT2NPC1RAB9AARKDM4E | |
| Hydrochloric Acid SCHEMBL27890957 | 0.81 | BCAT2 (0.65) | BCAT2PKN1PKN2PARP1MKNK1 | |
| Hydrochloric Acid SCHEMBL30165666 | 0.81 | BCAT2 (0.65) | BCAT2PKN1PKN2PARP1MKNK1 | |
| SCHEMBL30482280 | 0.80 | BCAT2 (0.63) | BCAT2NPC1RAB9ACSNK1A1TYRO3 | |
| SCHEMBL5878337 | 0.78 | BCAT2 (0.87) | BCAT2NPC1RAB9ACSNK1A1TYRO3 |
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-117263856-A | Nav1.8 inhibitors | 武汉人福创新药物研发中心有限公司 | 2023-12-22 | — | — | CN | disclosed |