Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 15/20 | 0.77 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.56 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.52 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL28546032 | 0.87 | BRD4 (1.00) | BRD4 | |
| SCHEMBL1799622 | 0.82 | ALDH1A1 (0.60) | BRD4CHEK2 | |
| SCHEMBL28910531 | 0.82 | BRD4 (0.72) | BRD4 | |
| SCHEMBL28539642 | 0.81 | BRD4 (0.65) | BRD4 | |
| SCHEMBL28539143 | 0.81 | BRD4 (0.74) | BRD4 | |
| SCHEMBL28539140 | 0.81 | BRD4 (1.00) | BRD4 | |
| SCHEMBL28546029 | 0.80 | BRD4 (1.00) | BRD4 | |
| SCHEMBL28547542 | 0.78 | BRD4 (1.00) | BRD4 | |
| SCHEMBL28542913 | 0.77 | BRD4 (1.00) | BRD4 | |
| SCHEMBL1802494 | 0.75 | BRD4 (0.59) | BRD4CHEK2 |
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-107739370-B | Preparation method and application of pyrrolidone BRD4 protein inhibitor | 中国药科大学 | 2021-03-30 | — | — | CN | disclosed |