Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 7/20 | 0.64 |
| ▸ | HDAC6 | Q9UBN7 | 6/20 | 0.64 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.64 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.64 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.64 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.64 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.64 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.64 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.64 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.64 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.64 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.64 |
| ▸ | CTBP2 | P56545 | 8/20 | 0.60 |
| ▸ | CA12 | O43570 | 4/20 | 0.60 |
| ▸ | CA1 | P00915 | 4/20 | 0.60 |
| ▸ | CA2 | P00918 | 4/20 | 0.60 |
| ▸ | CA9 | Q16790 | 4/20 | 0.60 |
| ▸ | CA4 | P22748 | 1/20 | 0.60 |
| ▸ | CA6 | P23280 | 1/20 | 0.60 |
| ▸ | CA5A | P35218 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL28458350 | 1.00 | HDAC1 (0.64) | HDAC1HDAC6HDAC3HDAC2HDAC7 | |
| SCHEMBL29939873 | 1.00 | HDAC1 (0.64) | HDAC1HDAC6HDAC3HDAC2HDAC7 | |
| SCHEMBL8442558 | 1.00 | HDAC1 (0.64) | HDAC1HDAC6HDAC3HDAC2HDAC7 | |
| SCHEMBL28452410 | 0.83 | HDAC1 (0.79) | HDAC1HDAC6HDAC3HDAC2HDAC7 | |
| SCHEMBL29940062 | 0.83 | HDAC1 (0.79) | HDAC1HDAC6HDAC3HDAC2HDAC7 | |
| SCHEMBL28452408 | 0.83 | HDAC1 (0.79) | HDAC1HDAC6HDAC3HDAC2HDAC7 | |
| Hemibastadin 1 SCHEMBL4751505 | 0.80 | PLK4 (0.82) | HDAC1HDAC6HDAC3HDAC2HDAC7 | |
| SCHEMBL28463572 | 0.80 | HDAC1 (0.77) | HDAC1HDAC6HDAC3HDAC2HDAC7 | |
| SCHEMBL28463571 | 0.80 | HDAC1 (0.77) | HDAC1HDAC6HDAC3HDAC2HDAC7 | |
| SCHEMBL29940238 | 0.80 | HDAC1 (0.77) | HDAC1HDAC6HDAC3HDAC2HDAC7 |
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-111548286-B | PSA derivative with HDAC3 inhibitory activity and application thereof | 沈阳药科大学 | 2022-09-06 | — | — | CN | disclosed |