Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.67 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.38 |
| ▸ | HSP90AB1 | P08238 | 3/20 | 0.38 |
| ▸ | SLC47A1 | Q96FL8 | 1/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.35 |
| ▸ | FDPS | P14324 | 1/20 | 0.34 |
| ▸ | HTR1B | P28222 | 1/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL24485296 | 0.77 | CYP2C19 (0.57) | ALDH1A1HPGDKAT2BMEN1NPC1 | |
| SCHEMBL18462183 | 0.77 | ALDH1A1 (0.62) | ALDH1A1HPGDMEN1NPC1RAB9A | |
| SCHEMBL3524349 | 0.76 | ALDH1A1 (0.76) | ALDH1A1HPGDSLC47A1ADRA1DADRA1A | |
| SCHEMBL15423534 | 0.73 | ALDH1A1 (0.58) | ALDH1A1HPGDMEN1NPC1RAB9A | |
| SCHEMBL13630788 | 0.73 | ALDH1A1 (0.58) | ALDH1A1HPGDMEN1NPC1RAB9A | |
| SCHEMBL11497625 | 0.73 | ALDH1A1 (0.71) | ALDH1A1HPGDMEN1KMT2ASLC47A1 | |
| SCHEMBL13074381 | 0.72 | ALDH1A1 (0.70) | ALDH1A1HPGDKMT2ASLC47A1ADRA1D | |
| SCHEMBL17788484 | 0.72 | ALDH1A1 (0.37) | ALDH1A1HSP90AA1HSP90AB1HTR1BHRH4 | |
| SCHEMBL14024944 | 0.72 | ALDH1A1 (0.56) | ALDH1A1HPGDMEN1NPC1RAB9A | |
| SCHEMBL20964586 | 0.72 | ALDH1A1 (0.55) | ALDH1A1HPGDMEN1NPC1RAB9A |
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 6 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-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-2003024448-A2 | INHIBITORS OF HISTONE DEACETYLASE | METHYLGENE, INC. (CA) | 2003-03-27 | — | — | WO | disclosed |