Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 20/20 | 0.77 |
| ▸ | HDAC1 | Q13547 | 19/20 | 0.77 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.75 |
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 | |
|---|---|---|---|---|
| SCHEMBL22827395 | 0.92 | BRD4 (0.75) | BRD4HDAC1HDAC6 | |
| SCHEMBL22827040 | 0.91 | BRD4 (0.66) | BRD4HDAC1HDAC6 | |
| SCHEMBL22827050 | 0.91 | BRD4 (0.77) | BRD4HDAC1HDAC6 | |
| SCHEMBL22827097 | 0.91 | BRD4 (0.75) | BRD4HDAC1HDAC6 | |
| SCHEMBL22827068 | 0.91 | BRD4 (0.75) | BRD4HDAC1HDAC6 | |
| SCHEMBL22827055 | 0.90 | BRD4 (0.77) | BRD4HDAC1HDAC6 | |
| SCHEMBL22827056 | 0.90 | BRD4 (0.77) | BRD4HDAC1HDAC6 | |
| SCHEMBL22826912 | 0.90 | BRD4 (0.77) | BRD4HDAC1HDAC6 | |
| SCHEMBL22826833 | 0.89 | BRD4 (0.64) | BRD4HDAC1HDAC6 | |
| SCHEMBL22827098 | 0.89 | BRD4 (0.76) | BRD4HDAC1HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020253711-A1 | PYRROLOPYRIDONE COMPOUND, PREPARATION METHOD THEREFOR, AND COMPOSITION AND USE THEREOF | 中国科学院上海药物研究所 | 2020-12-24 | — | — | WO | disclosed |