Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC2 | Q92769 | 7/20 | 0.53 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 8/20 | 0.52 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.46 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.46 |
| ▸ | IKBKB | O14920 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL25250993 | 0.92 | HDAC2 (0.51) | HDAC2PTGS2HDAC1HDAC3NCOR2 | |
| SCHEMBL31108970 | 0.85 | HDAC2 (0.52) | HDAC2HDAC1HDAC3KMT2AKLKB1 | |
| SCHEMBL15398017 | 0.84 | HDAC2 (0.74) | HDAC2HDAC1HDAC3 | |
| SCHEMBL25270031 | 0.84 | HDAC2 (0.47) | HDAC2HDAC1HDAC3KMT2AKLKB1 | |
| SCHEMBL15397942 | 0.82 | HDAC1 (0.60) | HDAC2HDAC1HDAC3NCOR2KLKB1 | |
| SCHEMBL13063863 | 0.80 | NPC1 (0.64) | HDAC2HDAC1HDAC3NCOR2KMT2A | |
| SCHEMBL31109008 | 0.79 | HDAC2 (0.58) | HDAC2HDAC1HDAC3 | |
| SCHEMBL25211678 | 0.79 | HDAC2 (0.66) | HDAC2HDAC1HDAC3 | |
| SCHEMBL25216641 | 0.79 | HDAC2 (0.66) | HDAC2HDAC1HDAC3 | |
| SCHEMBL25214205 | 0.79 | HDAC2 (0.66) | HDAC2HDAC1HDAC3 |
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-118715206-A | Novel HDAC inhibitors and therapeutic uses thereof | 探戈医药股份有限公司 | 2024-09-27 | — | — | CN | disclosed |