Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.68 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.68 |
| ▸ | HDAC1 | Q13547 | 12/20 | 0.63 |
| ▸ | EGFR | P00533 | 2/20 | 0.60 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.59 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.58 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.58 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.58 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.58 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.58 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.58 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.58 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.58 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.58 |
| ▸ | MEF2D | Q14814 | 1/20 | 0.57 |
| ▸ | MMP1 | P03956 | 3/20 | 0.56 |
| ▸ | MMP2 | P08253 | 3/20 | 0.56 |
| ▸ | MMP9 | P14780 | 3/20 | 0.56 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.55 |
| ▸ | PIM1 | P11309 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL4536420 | 1.00 | TRPA1 (0.68) | TRPA1TRPM8HDAC1EGFRHDAC2 | |
| SCHEMBL4536422 | 1.00 | TRPA1 (0.68) | TRPA1TRPM8HDAC1EGFRHDAC2 | |
| SCHEMBL2640602 | 0.88 | HDAC1 (0.66) | HDAC1EGFRHDAC2MMP1MMP2 | |
| SCHEMBL3228583 | 0.88 | EGFR (0.71) | HDAC1EGFRHDAC2HDAC4HDAC3 | |
| SCHEMBL3228591 | 0.88 | EGFR (0.71) | HDAC1EGFRHDAC2HDAC4HDAC3 | |
| SCHEMBL8349389 | 0.87 | HDAC1 (0.83) | HDAC1HDAC2HDAC4HDAC3HDAC7 | |
| SCHEMBL1064940 | 0.87 | HDAC1 (0.83) | HDAC1HDAC2HDAC4HDAC3HDAC7 | |
| SCHEMBL3565983 | 0.87 | HDAC1 (0.83) | HDAC1HDAC2HDAC4HDAC3HDAC7 | |
| SCHEMBL7978520 | 0.87 | HDAC1 (0.64) | HDAC1EGFRHDAC2MMP1MMP2 | |
| SCHEMBL13151248 | 0.86 | HDAC1 (0.62) | TRPA1TRPM8HDAC1HDAC2HDAC4 |
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 9 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-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-7838520-B2 | Inhibitors of histone deacetylase | METHYLGENE, INC. (CA) | 2010-11-23 | — | — | US | disclosed |
| EP-1590340-B1 | INHIBITORS OF HISTONE DEACETYLASE | METHYLGENE INC (CA) | 2010-04-07 | — | — | EP | 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 |
| WO-2004069823-A1 | INHIBITORS OF HISTONE DEACETYLASE | METHYLGENE, INC. (CA) | 2004-08-19 | — | — | WO | disclosed |
| WO-2003024448-A2 | INHIBITORS OF HISTONE DEACETYLASE | METHYLGENE, INC. (CA) | 2003-03-27 | — | — | WO | disclosed |