Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 12/20 | 0.73 |
| ▸ | HDAC2 | Q92769 | 13/20 | 0.57 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL4120548 | 0.90 | HDAC1 (0.76) | HDAC1HDAC2HDAC3KCNH2 | |
| SCHEMBL4578938 | 0.89 | HDAC1 (0.74) | HDAC1HDAC2HDAC3KCNH2 | |
| SCHEMBL3643627 | 0.88 | HDAC1 (0.73) | HDAC1HDAC2HDAC3KCNH2 | |
| SCHEMBL3643629 | 0.88 | HDAC1 (0.77) | HDAC1HDAC2HDAC3KCNH2 | |
| SCHEMBL3774949 | 0.85 | HDAC1 (0.74) | HDAC1HDAC2HDAC3KCNH2 | |
| SCHEMBL1689187 | 0.84 | HDAC1 (0.69) | HDAC1HDAC2HDAC3KCNH2 | |
| SCHEMBL25267595 | 0.84 | HDAC1 (0.68) | HDAC1HDAC2HDAC3KCNH2 | |
| SCHEMBL31109065 | 0.83 | HDAC1 (0.71) | HDAC1HDAC2HDAC3KCNH2 | |
| SCHEMBL4579933 | 0.82 | HDAC1 (0.72) | HDAC1HDAC2HDAC3KCNH2 | |
| SCHEMBL650082 | 0.82 | HDAC1 (0.74) | HDAC1HDAC2HDAC3KCNH2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2013196-A2 | DISUBSTITUTED ANILINE COMPOUNDS | Merck & Co., Inc. (US) | 2009-01-14 | — | — | EP | disclosed |
| WO-2007127137-A2 | DISUBSTITUTED ANILINE COMPOUNDS | MERCK & CO., INC. (US) | 2007-11-08 | — | — | WO | disclosed |