Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 19/20 | 0.55 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.55 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.55 |
| ▸ | NCOR2 | Q9Y618 | 4/20 | 0.40 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2107774 | 0.89 | HDAC1 (0.61) | HDAC1HDAC3HDAC2NCOR2 | |
| Bicarbonate SCHEMBL2109328 | 0.88 | HDAC1 (0.60) | HDAC1HDAC3HDAC2NCOR2 | |
| SCHEMBL1753682 | 0.76 | HDAC1 (0.63) | HDAC1HDAC3HDAC2NCOR2 | |
| SCHEMBL2108547 | 0.74 | HDAC1 (0.76) | HDAC1HDAC3HDAC2NCOR2 | |
| SCHEMBL247987 | 0.74 | CACNA1B (0.57) | HDAC1HDAC3HDAC2NCOR2 | |
| SCHEMBL1754325 | 0.72 | HDAC1 (1.00) | HDAC1HDAC3HDAC2NCOR2 | |
| SCHEMBL2107514 | 0.71 | HDAC1 (0.65) | HDAC1HDAC3HDAC2NCOR2 | |
| SCHEMBL1689184 | 0.71 | HDAC1 (0.90) | HDAC1HDAC3HDAC2NCOR2 | |
| SCHEMBL5032005 | 0.70 | HDAC1 (0.68) | HDAC1HDAC3HDAC2NCOR2SIRT2 | |
| SCHEMBL2108610 | 0.70 | HDAC1 (0.63) | HDAC1HDAC3HDAC2NCOR2 |
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-8158825-B2 | Modified malonate derivatives | MERCK SHARP & DOHME CORP. (US) | 2012-04-17 | — | — | US | disclosed |