Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC2 | Q92769 | 17/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 9/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL18079543 | 0.91 | HDAC2 (0.57) | HDAC2HDAC1 | |
| SCHEMBL18079545 | 0.87 | HDAC2 (0.66) | HDAC2HDAC1 | |
| SCHEMBL13739161 | 0.86 | HDAC2 (0.70) | HDAC2HDAC1 | |
| SCHEMBL18079542 | 0.84 | HDAC2 (0.55) | HDAC2HDAC1 | |
| SCHEMBL18079547 | 0.79 | HDAC2 (0.61) | HDAC2HDAC1 | |
| SCHEMBL13833513 | 0.76 | HDAC2 (0.73) | HDAC2HDAC1 | |
| SCHEMBL20364280 | 0.74 | HDAC2 (0.80) | HDAC2HDAC1 | |
| SCHEMBL18079549 | 0.73 | HDAC2 (0.60) | HDAC2HDAC1 | |
| SCHEMBL4534913 | 0.73 | NAMPT (0.52) | TP53 | |
| SCHEMBL13833449 | 0.73 | HDAC2 (0.78) | HDAC2HDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9447030-B2 | Inhibitors of histone deacetylase | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2016-09-20 | — | — | US | disclosed |