Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 5/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.38 |
| ▸ | LTB4R | Q15722 | 2/20 | 0.38 |
| ▸ | IKBKB | O14920 | 1/20 | 0.36 |
| ▸ | LTB4R2 | Q9NPC1 | 2/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.35 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.34 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.34 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.34 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.34 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3236466 | 0.91 | HDAC1 (0.41) | HDAC1HDAC3HDAC2LTB4RIKBKB | |
| SCHEMBL3236511 | 0.87 | HDAC3 (0.38) | HDAC1HDAC3HDAC2HDAC6 | |
| SCHEMBL3230256 | 0.85 | HDAC3 (0.38) | HDAC1HDAC3HDAC2LTB4R2HDAC6 | |
| SCHEMBL3235377 | 0.81 | HDAC3 (0.42) | HDAC1HDAC3HDAC2HDAC10ALDH1A1 | |
| SCHEMBL3238241 | 0.80 | MEN1 (0.34) | HDAC1HDAC3HDAC6MEN1KMT2A | |
| SCHEMBL3241080 | 0.79 | MPO (0.40) | HDAC1HDAC3GAAMAPT | |
| SCHEMBL3235350 | 0.78 | MAPT (0.46) | HDAC1HDAC3IKBKBMEN1KMT2A | |
| SCHEMBL3242812 | 0.77 | ALDH1A1 (0.40) | HDAC1HDAC3HDAC2HDAC6HDAC4 | |
| SCHEMBL16369620 | 0.77 | ALDH1A1 (0.40) | HDAC1HDAC3HDAC2HDAC6HDAC4 | |
| SCHEMBL3234039 | 0.75 | HDAC3 (0.34) | HDAC1HDAC3HDAC2HDAC6HDAC4 |
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-2010028193-A1 | COMPOUNDS INCLUDING PIMELIC ACID DERIVATIVES AS HDAC INHIBITORS | REPLIGEN CORPORATION (US) | 2010-03-11 | — | — | WO | disclosed |