Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNA2 | P20248 | 19/20 | 0.39 |
| ▸ | CDK2 | P24941 | 19/20 | 0.39 |
| ▸ | CCNA1 | P78396 | 19/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28574771 | 0.85 | HDAC6 (0.44) | CCNA2CDK2CCNA1HDAC3HDAC4 | |
| SCHEMBL28574656 | 0.84 | HDAC3 (0.40) | HDAC3HDAC4HDAC1HDAC2HDAC8 | |
| SCHEMBL28582800 | 0.83 | RAB9A (0.44) | CCNA2CDK2CCNA1HDAC3HDAC4 | |
| SCHEMBL28568415 | 0.82 | NAAA (0.38) | HDAC3HDAC4HDAC1HDAC2HDAC8 | |
| SCHEMBL28568974 | 0.81 | HDAC3 (0.35) | HDAC3HDAC4HDAC1HDAC2HDAC8 | |
| SCHEMBL28576372 | 0.80 | HDAC3 (0.40) | HDAC3HDAC4HDAC1HDAC2HDAC8 | |
| SCHEMBL28582772 | 0.79 | HDAC3 (0.37) | HDAC3HDAC4HDAC1HDAC2HDAC8 | |
| SCHEMBL28573732 | 0.78 | ITK (0.36) | HDAC3HDAC4HDAC1HDAC2HDAC8 | |
| SCHEMBL28576387 | 0.78 | HDAC3 (0.33) | HDAC3HDAC4HDAC1HDAC2HDAC8 | |
| SCHEMBL28914562 | 0.76 | HDAC3 (0.36) | HDAC3HDAC4HDAC1HDAC2HDAC8 |
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-109384793-B | Thiol compound with HDAC6 inhibitory activity and application thereof | 沈阳药科大学 | 2021-05-07 | — | — | CN | claimed |
| CN-109384793-B | Thiol compound with HDAC6 inhibitory activity and application thereof | 沈阳药科大学 | 2021-05-07 | — | — | CN | disclosed |