Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 2/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.46 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.46 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.46 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 8/20 | 0.40 |
| ▸ | RAB9A | P51151 | 7/20 | 0.40 |
| ▸ | MAPT | P10636 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.39 |
| ▸ | MEN1 | O00255 | 5/20 | 0.39 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14716098 | 0.86 | HDAC3 (0.46) | HDAC3HDAC4HDAC1HDAC7HDAC8 | |
| SCHEMBL14716204 | 0.78 | HDAC3 (0.50) | HDAC3HDAC4HDAC1HDAC7HDAC8 | |
| SCHEMBL27293915 | 0.76 | MAPT (0.56) | HDAC3HDAC4HDAC1HDAC7HDAC8 | |
| SCHEMBL14829917 | 0.75 | NPC1 (0.44) | HDAC3HDAC4HDAC1HDAC7HDAC8 | |
| SCHEMBL14830113 | 0.75 | HSD17B1 (0.50) | HDAC3HDAC4HDAC1HDAC7HDAC8 | |
| SCHEMBL14809051 | 0.75 | HDAC3 (0.50) | HDAC3HDAC4HDAC1HDAC7HDAC8 | |
| SCHEMBL28233883 | 0.73 | CHEK2 (0.39) | HDAC3HDAC4HDAC1HDAC7HDAC8 | |
| SCHEMBL19647638 | 0.73 | PBRM1 (0.59) | HDAC3HDAC4HDAC1HDAC7HDAC8 | |
| SCHEMBL14829604 | 0.72 | HSD17B1 (0.49) | HDAC3HDAC4HDAC1HDAC7HDAC8 | |
| SCHEMBL14784332 | 0.72 | KCNQ3 (0.48) | HDAC3HDAC4HDAC1HDAC7HDAC8 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2755657-B1 | CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS | NEUPHARMA INC (US) | 2017-11-29 | — | — | EP | disclosed |