Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 10/20 | 0.42 |
| ▸ | ADAM10 | O14672 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP3 | P08254 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30565889 | 0.90 | BTK (0.42) | BTKADAM10MMP2MMP3MMP9 | |
| SCHEMBL30565860 | 0.90 | BTK (0.51) | BTK | |
| SCHEMBL30565885 | 0.83 | ADAM10 (0.41) | BTKADAM10MMP2MMP3MMP9 | |
| SCHEMBL22904753 | 0.81 | BTK (0.41) | BTKPOLB | |
| SCHEMBL30565888 | 0.81 | BTK (0.51) | BTK | |
| SCHEMBL594301 | 0.78 | GRIN2B (0.49) | OPRD1OPRK1 | |
| SCHEMBL26359420 | 0.77 | GRIN2B (0.46) | OPRD1OPRK1 | |
| SCHEMBL29593305 | 0.74 | PTGDR2 (0.41) | POLB | |
| SCHEMBL26361509 | 0.74 | IGF1R (0.39) | POLB | |
| SCHEMBL21783734 | 0.73 | TEC (0.47) | BTK |
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-112209934-B | BTK inhibitors containing azaspiroheptane | 正大天晴药业集团股份有限公司 | 2023-09-08 | — | — | CN | disclosed |
| 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 |