Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNT1 | O60563 | 6/20 | 0.55 |
| ▸ | CDK9 | P50750 | 6/20 | 0.55 |
| ▸ | JAK1 | P23458 | 1/20 | 0.47 |
| ▸ | CNR1 | P21554 | 1/20 | 0.45 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.45 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.42 |
| ▸ | GRM1 | Q13255 | 5/20 | 0.42 |
| ▸ | GRM5 | P41594 | 4/20 | 0.42 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.42 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | KIT | P10721 | 1/20 | 0.41 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL22476358 | 1.00 | CCNT1 (0.55) | CCNT1CDK9JAK1CNR1TBK1 | |
| SCHEMBL5005001 | 0.87 | CCNT1 (0.58) | CCNT1CDK9JAK1CNR1TBK1 | |
| SCHEMBL29110613 | 0.84 | DHFR (0.44) | CCNT1CDK9 | |
| SCHEMBL22476348 | 0.83 | CCNT1 (0.41) | CCNT1CDK9 | |
| SCHEMBL5008189 | 0.81 | CDK9 (0.55) | CCNT1CDK9JAK1CNR1TBK1 | |
| SCHEMBL5665564 | 0.80 | CDK9 (0.66) | CCNT1CDK9TBK1 | |
| SCHEMBL5008221 | 0.79 | CDK9 (0.51) | CCNT1CDK9JAK1CNR1TBK1 | |
| SCHEMBL16967833 | 0.78 | CDK9 (0.66) | CCNT1CDK9TBK1 | |
| SCHEMBL13994153 | 0.78 | CCNT1 (0.51) | CCNT1CDK9JAK1CNR1TBK1 | |
| SCHEMBL14500418 | 0.76 | CDK9 (0.60) | CCNT1CDK9TBK1 |
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-116854709-A | Reversible inhibitors of Bruton's tyrosine kinase and application thereof | 药雅科技(上海)有限公司 | 2023-10-10 | — | — | CN | disclosed |