Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 2/20 | 0.51 |
| ▸ | JAK3 | P52333 | 1/20 | 0.51 |
| ▸ | SUV39H2 | Q9H5I1 | 12/20 | 0.50 |
| ▸ | CKS1B | P61024 | 1/20 | 0.48 |
| ▸ | SKP1 | P63208 | 1/20 | 0.48 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.48 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.46 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.45 |
| ▸ | AURKA | O14965 | 2/20 | 0.44 |
| ▸ | PDPK1 | O15530 | 2/20 | 0.44 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL31518429 | 0.87 | BTK (0.55) | BTKJAK3SUV39H2CKS1BSKP1 | |
| SCHEMBL24851725 | 0.87 | BTK (0.57) | BTKJAK3SUV39H2CKS1BSKP1 | |
| SCHEMBL31539345 | 0.87 | BTK (0.55) | BTKJAK3SUV39H2CKS1BSKP1 | |
| SCHEMBL5222133 | 0.84 | CKS1B (0.51) | BTKJAK3SUV39H2CKS1BSKP1 | |
| SCHEMBL13940552 | 0.83 | MAP4K4 (0.52) | BTKJAK3SUV39H2CKS1BSKP1 | |
| SCHEMBL13472393 | 0.83 | MAP4K4 (0.52) | BTKJAK3SUV39H2CKS1BSKP1 | |
| SCHEMBL12484351 | 0.83 | BTK (0.51) | BTKJAK3SUV39H2CKS1BSKP1 | |
| SCHEMBL12484356 | 0.83 | BTK (0.51) | BTKJAK3SUV39H2CKS1BSKP1 | |
| SCHEMBL24851466 | 0.81 | CKS1B (0.54) | BTKJAK3SUV39H2CKS1BSKP1 | |
| SCHEMBL1588740 | 0.81 | JAK3 (0.55) | BTKJAK3SUV39H2CKS1BSKP1 |
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-105939998-B | Heteroaryl compound and application thereof as BTK inhibitor | 默克专利有限公司 | 2019-04-16 | — | — | CN | disclosed |