Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.55 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.55 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.55 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.55 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.55 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.55 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.55 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.55 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.55 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.55 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.55 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 4/20 | 0.46 |
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | KDM1A | O60341 | 2/20 | 0.45 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.42 |
| ▸ | DNMT3A | Q9Y6K1 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL14789609 | 0.85 | HDAC3 (0.57) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL9943802 | 0.81 | HDAC1 (0.50) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL22071363 | 0.80 | HDAC6 (0.75) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL20214537 | 0.77 | HDAC6 (0.70) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL20226817 | 0.73 | HDAC1 (0.64) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL15480475 | 0.72 | HDAC1 (0.72) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL27545723 | 0.71 | SMN1; SMN2 (0.49) | NPC1RAB9AMEN1KMT2ASMN1; SMN2 | |
| Givinostat SCHEMBL1555814 | 0.71 | HDAC6 (1.00) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL15480672 | 0.71 | HDAC6 (0.84) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| Givinostat SCHEMBL29361624 | 0.71 | HDAC6 (1.00) | HDAC1HDAC6HDAC3HDAC4HDAC7 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011018241-A1 | METHODS FOR THE IDENTIFICATION AND CHARACTERIZATION OF HDAC INTERACTING COMPOUNDS | CELLZOME AG (DE) | 2011-02-17 | — | — | WO | disclosed |