Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 17/20 | 0.76 |
| ▸ | DRD2 | P14416 | 3/20 | 0.60 |
| ▸ | DRD4 | P21917 | 3/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL3643428 | 0.86 | HDAC1 (1.00) | HDAC1 | |
| SCHEMBL3641844 | 0.86 | HDAC1 (1.00) | HDAC1 | |
| SCHEMBL3642229 | 0.82 | HDAC1 (1.00) | HDAC1 | |
| SCHEMBL3642231 | 0.80 | HDAC1 (1.00) | HDAC1 | |
| SCHEMBL3637331 | 0.80 | HDAC1 (1.00) | HDAC1 | |
| SCHEMBL2734633 | 0.80 | DRD2 (0.61) | DRD2DRD4 | |
| SCHEMBL3643330 | 0.80 | HDAC1 (1.00) | HDAC1 | |
| SCHEMBL13060567 | 0.78 | HDAC1 (0.86) | HDAC1 | |
| SCHEMBL12117911 | 0.78 | HDAC1 (0.58) | HDAC1 | |
| SCHEMBL3685031 | 0.78 | HDAC1 (1.00) | HDAC1 |
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-2009002495-A1 | 4-CARBOXYBENZYLAMINO DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS | MERCK & CO., INC. (US) | 2008-12-31 | — | — | WO | disclosed |