Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 20/20 | 0.69 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.69 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.58 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.58 |
| ▸ | EGFR | P00533 | 1/20 | 0.58 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.58 |
| ▸ | TEC | P42680 | 1/20 | 0.58 |
| ▸ | TXK | P42681 | 1/20 | 0.58 |
| ▸ | BLK | P51451 | 1/20 | 0.58 |
| ▸ | BMX | P51813 | 1/20 | 0.58 |
| ▸ | JAK3 | P52333 | 1/20 | 0.58 |
| ▸ | ITK | Q08881 | 1/20 | 0.58 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.58 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL31474197 | 0.94 | BTK (0.70) | BTKCYP2D6KCNH2ABCB11EGFR | |
| SCHEMBL31474010 | 0.85 | BTK (0.68) | BTKCYP2D6KCNH2ABCB11EGFR | |
| SCHEMBL31474225 | 0.85 | BTK (0.54) | BTKCYP2D6KCNH2ABCB11EGFR | |
| SCHEMBL31473978 | 0.84 | BTK (0.56) | BTKCYP2D6KCNH2ABCB11EGFR | |
| SCHEMBL31474124 | 0.84 | BTK (0.62) | BTKCYP2D6KCNH2ABCB11EGFR | |
| SCHEMBL31474234 | 0.83 | BTK (0.66) | BTKCYP2D6KCNH2ABCB11EGFR | |
| SCHEMBL29508563 | 0.82 | BTK (1.00) | BTKCYP2D6KCNH2ABCB11EGFR | |
| SCHEMBL16754833 | 0.82 | BTK (1.00) | BTKCYP2D6KCNH2ABCB11EGFR | |
| SCHEMBL31474028 | 0.81 | BTK (0.69) | BTKCYP2D6KCNH2ABCB11EGFR | |
| SCHEMBL31474099 | 0.80 | BTK (0.67) | BTKCYP2D6KCNH2ABCB11EGFR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2025061148-A1 | HETEROARYL COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF IN MEDICINE | 江苏恒瑞医药股份有限公司 | 2025-03-27 | — | — | WO | disclosed |