Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 16/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 14/20 | 0.54 |
| ▸ | HDAC3 | O15379 | 13/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 13/20 | 0.54 |
| ▸ | HDAC2 | Q92769 | 12/20 | 0.54 |
| ▸ | HDAC11 | Q96DB2 | 11/20 | 0.54 |
| ▸ | HDAC10 | Q969S8 | 10/20 | 0.54 |
| ▸ | HDAC4 | P56524 | 7/20 | 0.54 |
| ▸ | HDAC7 | Q8WUI4 | 7/20 | 0.54 |
| ▸ | HDAC9 | Q9UKV0 | 7/20 | 0.54 |
| ▸ | HDAC5 | Q9UQL6 | 7/20 | 0.54 |
| ▸ | NCOR2 | Q9Y618 | 5/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | BRD4 | O60885 | 1/20 | 0.51 |
| ▸ | NCOR1 | O75376 | 1/20 | 0.51 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.51 |
| ▸ | EGFR | P00533 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | LTA4H | P09960 | 1/20 | 0.51 |
| ▸ | NR0B1 | P51843 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL13288542 | 0.92 | HDAC2 (0.60) | HDAC8HDAC6HDAC3HDAC1HDAC2 | |
| SCHEMBL27659478 | 0.80 | HDAC8 (0.60) | HDAC8HDAC6HDAC3HDAC1HDAC2 | |
| SCHEMBL27659488 | 0.79 | HDAC8 (0.52) | HDAC8HDAC6HDAC3HDAC1HDAC2 | |
| SCHEMBL27659497 | 0.77 | HDAC8 (0.57) | HDAC8HDAC6HDAC3HDAC1HDAC2 | |
| SCHEMBL27679543 | 0.76 | HDAC8 (0.61) | HDAC8HDAC6HDAC3HDAC1HDAC2 | |
| SCHEMBL28760349 | 0.75 | HDAC8 (0.60) | HDAC8HDAC6HDAC3HDAC1HDAC2 | |
| SCHEMBL27679660 | 0.75 | HDAC8 (0.60) | HDAC8HDAC6HDAC3HDAC1HDAC2 | |
| SCHEMBL27679616 | 0.74 | HDAC8 (0.56) | HDAC8HDAC6HDAC3HDAC1HDAC2 | |
| SCHEMBL27659494 | 0.74 | HDAC8 (0.54) | HDAC8HDAC6HDAC3HDAC1HDAC2 | |
| SCHEMBL6877136 | 0.74 | HDAC8 (0.68) | HDAC8HDAC6HDAC3HDAC1HDAC2 |
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-1997627-A | Histone deacetylase inhibitors | MERCK & CO INC (US) | 2007-07-11 | — | — | CN | disclosed |