Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 18/20 | 1.00 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | AURKA | O14965 | 1/20 | 0.50 |
| ▸ | CDK1 | P06493 | 1/20 | 0.50 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.50 |
| ▸ | CDK2 | P24941 | 1/20 | 0.50 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL28451053 | 0.84 | BRD4 (0.73) | BRD4SMN1; SMN2 | |
| SCHEMBL30532574 | 0.84 | BRD4 (0.73) | BRD4SMN1; SMN2 | |
| SCHEMBL28539261 | 0.81 | BRD4 (0.77) | BRD4 | |
| SCHEMBL28544075 | 0.79 | BRD4 (0.65) | BRD4SMN1; SMN2 | |
| SCHEMBL28911157 | 0.79 | BRD4 (0.65) | BRD4SMN1; SMN2 | |
| SCHEMBL28539642 | 0.79 | BRD4 (0.65) | BRD4 | |
| SCHEMBL28546032 | 0.78 | BRD4 (1.00) | BRD4SMN1; SMN2 | |
| SCHEMBL28546029 | 0.78 | BRD4 (1.00) | BRD4 | |
| SCHEMBL1799622 | 0.73 | ALDH1A1 (0.60) | BRD4SMN1; SMN2 | |
| SCHEMBL1799620 | 0.73 | BRD4 (0.57) | BRD4SMN1; SMN2 |
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-107739370-B | Preparation method and application of pyrrolidone BRD4 protein inhibitor | 中国药科大学 | 2021-03-30 | — | — | CN | claimed |
| CN-107739370-B | Preparation method and application of pyrrolidone BRD4 protein inhibitor | 中国药科大学 | 2021-03-30 | — | — | CN | disclosed |