Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.45 |
| ▸ | LMNA | P02545 | 5/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.40 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | HRH1 | P35367 | 1/20 | 0.37 |
| ▸ | TNKS | O95271 | 1/20 | 0.37 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4283486 | 1.00 | KDM4E (0.45) | KDM4ELMNAHDAC3HDAC4HDAC1 | |
| SCHEMBL1878437 | 0.88 | HDAC3 (0.38) | KDM4ELMNAHDAC3HDAC4HDAC1 | |
| SCHEMBL27764267 | 0.85 | KDM4E (0.44) | KDM4ELMNAHDAC3HDAC4HDAC1 | |
| SCHEMBL12904542 | 0.85 | ALDH1A1 (0.45) | KDM4ELMNAHDAC6OPRK1XPO1 | |
| SCHEMBL1580130 | 0.84 | LMNA (0.46) | KDM4ELMNAOPRK1PTGS2HTT | |
| SCHEMBL1580131 | 0.82 | TBXAS1 (0.36) | KDM4ELMNAHDAC3HDAC4HDAC1 | |
| SCHEMBL946064 | 0.81 | LMNA (0.37) | KDM4ELMNAHDAC3HDAC4HDAC1 | |
| SCHEMBL946916 | 0.81 | LMNA (0.37) | KDM4ELMNAHDAC3HDAC4HDAC1 | |
| SCHEMBL946065 | 0.81 | LMNA (0.37) | KDM4ELMNAHDAC3HDAC4HDAC1 | |
| SCHEMBL13217232 | 0.80 | XPO1 (0.34) | KDM4ELMNAHDAC3HDAC4HDAC1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2310364-B1 | HETEROCYCLIC DERIVATIVES AS HDAC INHIBITORS | DAC SRL (IT) | 2013-01-02 | — | — | EP | disclosed |
| WO-2009150129-A1 | HETEROCYCLIC DERIVATIVES AS HDAC INHIBITORS | DAC S.R.L. (IT) | 2009-12-17 | — | — | WO | disclosed |
| EP-2133334-A1 | Heterocyclic derivatives as HDAC inhibitors | DAC S.r.l. (IT) | 2009-12-16 | — | — | EP | disclosed |