Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 14/20 | 0.41 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | KCNK3 | O14649 | 2/20 | 0.31 |
| ▸ | KCNK9 | Q9NPC2 | 2/20 | 0.31 |
| ▸ | NAMPT | P43490 | 1/20 | 0.31 |
| ▸ | EIF2AK4 | Q9P2K8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21461728 | 0.89 | BTK (0.41) | BTKTNK2POLBKCNK3KCNK9 | |
| SCHEMBL22904751 | 0.89 | BTK (0.50) | BTKTNK2 | |
| SCHEMBL20415500 | 0.82 | BTK (0.36) | BTKTNK2POLBKCNK3KCNK9 | |
| SCHEMBL21461736 | 0.82 | BTK (0.36) | BTKTNK2POLBKCNK3KCNK9 | |
| SCHEMBL30565868 | 0.81 | BTK (0.42) | BTKPOLB | |
| SCHEMBL20415459 | 0.80 | BTK (0.50) | BTKTNK2 | |
| SCHEMBL20415461 | 0.80 | BTK (0.50) | BTKTNK2 | |
| SCHEMBL26791467 | 0.75 | TNK2 (0.38) | BTKTNK2POLBKCNK3KCNK9 | |
| SCHEMBL26791423 | 0.74 | TNK2 (0.50) | BTKTNK2POLB | |
| SCHEMBL20415501 | 0.74 | BTK (0.36) | BTKNAMPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113993871-B | BTK inhibitors containing 5-azacycloheptane | 正大天晴药业集团股份有限公司 | 2023-08-01 | — | — | CN | disclosed |
| WO-2021008441-A1 | BTK INHIBITOR CONTAINING 5-AZASPIROHEPTANE | 正大天晴药业集团股份有限公司 | 2021-01-21 | — | — | WO | disclosed |