Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 17/20 | 0.97 |
| ▸ | HDAC1 | Q13547 | 16/20 | 0.97 |
| ▸ | HDAC2 | Q92769 | 16/20 | 0.97 |
| ▸ | HDAC3 | O15379 | 15/20 | 0.68 |
| ▸ | HDAC8 | Q9BY41 | 14/20 | 0.68 |
| ▸ | HDAC11 | Q96DB2 | 12/20 | 0.68 |
| ▸ | HDAC4 | P56524 | 12/20 | 0.68 |
| ▸ | HDAC5 | Q9UQL6 | 12/20 | 0.68 |
| ▸ | HDAC10 | Q969S8 | 11/20 | 0.68 |
| ▸ | HDAC7 | Q8WUI4 | 11/20 | 0.68 |
| ▸ | HDAC9 | Q9UKV0 | 11/20 | 0.68 |
| ▸ | CA12 | O43570 | 1/20 | 0.59 |
| ▸ | CA1 | P00915 | 1/20 | 0.59 |
| ▸ | CA2 | P00918 | 1/20 | 0.59 |
| ▸ | CA9 | Q16790 | 1/20 | 0.59 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.57 |
| ▸ | NCOR1 | O75376 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | BRD4 | O60885 | 1/20 | 0.56 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL28149475 | 0.86 | HDAC6 (0.78) | HDAC6HDAC1HDAC2HDAC3HDAC8 | |
| SCHEMBL28142485 | 0.86 | HDAC6 (0.78) | HDAC6HDAC1HDAC2HDAC3HDAC8 | |
| SCHEMBL7907639 | 0.83 | HDAC6 (0.89) | HDAC6HDAC1HDAC2HDAC3HDAC8 | |
| SCHEMBL7914324 | 0.83 | HDAC6 (0.89) | HDAC6HDAC1HDAC2HDAC3HDAC8 | |
| SCHEMBL2113387 | 0.82 | HDAC6 (0.68) | HDAC6HDAC1HDAC2HDAC3HDAC8 | |
| SCHEMBL15101639 | 0.81 | HDAC6 (0.66) | HDAC6HDAC1HDAC2HDAC3HDAC8 | |
| SCHEMBL31635263 | 0.81 | HDAC1 (0.83) | HDAC6HDAC1HDAC2HDAC3HDAC8 | |
| SCHEMBL17277184 | 0.79 | HDAC6 (0.63) | HDAC6HDAC1HDAC2HDAC3HDAC8 | |
| SCHEMBL4789384 | 0.79 | CA12 (0.75) | HDAC6HDAC1HDAC2HDAC3HDAC8 | |
| SCHEMBL3498956 | 0.78 | HDAC6 (0.62) | HDAC6HDAC1HDAC2HDAC3HDAC8 |
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-106905191-B | A kind of nitrogen mustards compound and its preparation method and application containing hydroxamic acid group | 北京化工大学 | 2019-03-29 | — | — | CN | disclosed |