Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 3/20 | 0.44 |
| ▸ | KAT2B | Q92831 | 5/20 | 0.43 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.41 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.38 |
| ▸ | JAK3 | P52333 | 5/20 | 0.37 |
| ▸ | IL1B | P01584 | 4/20 | 0.37 |
| ▸ | BPTF | Q12830 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | JAK1 | P23458 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21899804 | 0.84 | BTK (0.47) | BTKJAK3EGFRJAK1 | |
| SCHEMBL24464321 | 0.82 | HPGDS (0.44) | EGFRJAK1 | |
| SCHEMBL14647420 | 0.80 | BTK (0.50) | BTKJAK3EGFRJAK1 | |
| SCHEMBL21900351 | 0.79 | BTK (0.49) | BTKJAK3EGFRJAK1 | |
| SCHEMBL21899548 | 0.78 | BTK (0.49) | BTKJAK3EGFRJAK1 | |
| SCHEMBL21159574 | 0.78 | KAT2B (0.46) | BTKKAT2BLRRK2NLRP3CHEK1 | |
| SCHEMBL24196488 | 0.78 | BTK (0.61) | BTKKAT2BEGFR | |
| SCHEMBL19649120 | 0.78 | BTK (0.61) | BTKKAT2BEGFR | |
| SCHEMBL26411460 | 0.76 | PIK3CD (0.42) | BTKKAT2B | |
| SCHEMBL18518271 | 0.76 | CHEK1 (0.44) | BTKKAT2BLRRK2NLRP3CHEK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3257855-B1 | METHOD FOR PREPARING IBRUTINIB | SHANGHAI DUDE MEDICAL SCIENCE AND TECH CO LTD (CN) | 2020-04-22 | — | — | EP | disclosed |