Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.45 |
| ▸ | RAB9A | P51151 | 6/20 | 0.45 |
| ▸ | KIF11 | P52732 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | CDK2 | P24941 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.40 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6469190 | 0.74 | MAPK1 (0.43) | ALDH1A1 | |
| SCHEMBL19151634 | 0.69 | ADORA3 (0.42) | KCNH2SCN9ALMNA | |
| SCHEMBL31636273 | 0.69 | ADORA3 (0.42) | KCNH2SCN9ALMNA | |
| SCHEMBL19447116 | 0.69 | CSF1R (0.53) | — | |
| SCHEMBL5042271 | 0.68 | HCAR3 (0.39) | GAALMNAMEN1KMT2AL3MBTL1 | |
| SCHEMBL2789615 | 0.68 | RAB9A (0.64) | NPC1RAB9AALDH1A1NFKB1CDK2 | |
| SCHEMBL6468902 | 0.68 | FYN (0.46) | CDK2KCNH2SCN9AP2RX3 | |
| SCHEMBL7109264 | 0.67 | TSHR (0.56) | ALDH1A1KCNH2LMNAKMT2A | |
| SCHEMBL23080875 | 0.66 | NPC1 (0.44) | NPC1RAB9AKIF11ALDH1A1NFKB1 | |
| SCHEMBL27987796 | 0.66 | MAP3K14 (0.47) | SCN9ABRAF |
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-107709315-A | The inhibitor of bruton's tyrosine kinase | 药品循环有限责任公司 | 2018-02-16 | — | — | CN | disclosed |