Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 4/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29755002 | 1.00 | AAK1 (0.36) | AAK1HDAC1HDAC6HDAC5 | |
| SCHEMBL24676592 | 0.81 | — | — | |
| SCHEMBL29754856 | 0.81 | — | — | |
| SCHEMBL29754910 | 0.76 | ATF1 (0.32) | — | |
| SCHEMBL29754824 | 0.75 | ATF1 (0.32) | — | |
| SCHEMBL24675972 | 0.75 | ATF1 (0.32) | — | |
| SCHEMBL24676665 | 0.74 | GPR119 (0.40) | — | |
| SCHEMBL24676466 | 0.73 | KDM4E (0.35) | AAK1 | |
| SCHEMBL29754990 | 0.73 | KDM4E (0.35) | AAK1 | |
| SCHEMBL24675985 | 0.71 | — | — |
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-2022155941-A1 | CDK2 INHIBITORS | QILU REGOR THERAPEUTICS INC. (CN) | 2022-07-28 | — | — | WO | disclosed |