Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.45 |
| ▸ | PRKAA2 | P54646 | 2/20 | 0.39 |
| ▸ | GPR6 | P46095 | 4/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.37 |
| ▸ | FAAH | O00519 | 1/20 | 0.37 |
| ▸ | SCD | O00767 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.35 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.35 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1067870 | 0.81 | KCNH2 (0.70) | KCNH2HDAC2HDAC3HDAC1CYP1A2 | |
| SCHEMBL1066695 | 0.78 | KCNH2 (0.56) | KCNH2PRKAA2GPR6HDAC2HDAC3 | |
| SCHEMBL1066698 | 0.76 | KCNH2 (0.44) | KCNH2PRKAA2GPR6HDAC2FAAH | |
| SCHEMBL8292821 | 0.75 | KCNH2 (0.54) | KCNH2PRKAA2GPR6HDAC2HDAC3 | |
| SCHEMBL1066722 | 0.73 | ALDH1A1 (0.50) | PRKAA2GPR6HDAC2FAAHSCD | |
| SCHEMBL1065675 | 0.72 | GPR6 (0.50) | PRKAA2GPR6FAAHSCDALDH1A1 | |
| SCHEMBL8292309 | 0.72 | KCNH2 (0.76) | KCNH2HDAC2HDAC3HDAC1CYP1A2 | |
| SCHEMBL12933498 | 0.70 | KCNH2 (0.70) | KCNH2HDAC2HDAC3HDAC1CYP1A2 | |
| SCHEMBL5226372 | 0.68 | HDAC2 (0.61) | KCNH2HDAC2SCDHDAC3HDAC4 | |
| SCHEMBL4198413 | 0.66 | HDAC4 (0.71) | KCNH2HDAC2SCDHDAC3HDAC4 |
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-2005030704-A1 | INHIBITORS OF HISTONE DEACETYLASE | METHYLGENE, INC. (CA) | 2005-04-07 | — | — | WO | disclosed |