Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.42 |
| ▸ | GRK2 | P25098 | 1/20 | 0.40 |
| ▸ | DDR1 | Q08345 | 7/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | EIF4EBP1 | Q13541 | 1/20 | 0.39 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.38 |
| ▸ | FDPS | P14324 | 1/20 | 0.38 |
| ▸ | TNF | P01375 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8351342 | 0.85 | HDAC6 (0.44) | HDAC6GRK2DDR1ALDH1A1EIF4EBP1 | |
| SCHEMBL12963491 | 0.81 | SMN1; SMN2 (0.50) | HDAC6GRK2ALDH1A1EIF4EBP1TNF | |
| SCHEMBL12933333 | 0.81 | HDAC6 (0.65) | HDAC6GRK2ALDH1A1TNFMAPK1 | |
| SCHEMBL18026639 | 0.76 | SMN1; SMN2 (0.58) | ALDH1A1 | |
| SCHEMBL31123009 | 0.76 | HDAC6 (0.40) | HDAC6GRK2DDR1ALDH1A1TNF | |
| SCHEMBL12388859 | 0.70 | TNF (0.42) | HDAC6GRK2ALDH1A1EIF4EBP1TNF | |
| SCHEMBL22393621 | 0.70 | MEN1 (0.48) | DDR1ALDH1A1MAPK1 | |
| SCHEMBL25904008 | 0.69 | EIF4EBP1 (0.41) | HDAC6GRK2DDR1ALDH1A1EIF4EBP1 | |
| SCHEMBL25776184 | 0.69 | NFE2L2 (0.48) | HDAC6DDR1ALDH1A1TNF | |
| SCHEMBL15680582 | 0.68 | TNF (0.60) | HDAC6ALDH1A1TNF |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7868204-B2 | Inhibitors of histone deacetylase | METHYLGENE INC. (CA) | 2011-01-11 | — | — | US | disclosed |
| US-7838520-B2 | Inhibitors of histone deacetylase | METHYLGENE, INC. (CA) | 2010-11-23 | — | — | US | disclosed |
| US-7595343-B2 | Inhibitors of histone deacetylase | METHYLGENE, INC. (CA) | 2009-09-29 | — | — | US | disclosed |
| US-7595343-B2 | Inhibitors of histone deacetylase | METHYLGENE, INC. (CA) | 2009-09-29 | — | — | US | disclosed |