Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.46 |
| ▸ | PARG | Q86W56 | 2/20 | 0.43 |
| ▸ | HPD | P32754 | 4/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | PDE4A | P27815 | 2/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.41 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL17434513 | 0.91 | PARG (0.50) | ALDH1A1SMN1; SMN2PARGTSHRKMT2A | |
| SCHEMBL12933344 | 0.84 | PARG (0.43) | ALDH1A1SMN1; SMN2PARGTSHRKMT2A | |
| SCHEMBL1921148 | 0.79 | MAPT (0.51) | ALDH1A1SMN1; SMN2KMT2AKDM4EGAA | |
| SCHEMBL29556827 | 0.79 | MAPT (0.51) | ALDH1A1SMN1; SMN2KMT2AKDM4EGAA | |
| SCHEMBL12963428 | 0.78 | PGR (0.61) | ALDH1A1SMN1; SMN2KMT2AKDM4EGAA | |
| SCHEMBL29209040 | 0.77 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2HPDTSHRKMT2A | |
| SCHEMBL10084697 | 0.77 | PGR (0.57) | ADORA2BHPDKDM4EADORA2ANPC1 | |
| SCHEMBL20227728 | 0.76 | PGR (0.58) | ALDH1A1SMN1; SMN2KMT2AGSK3BKDM4E | |
| SCHEMBL871702 | 0.75 | MAPT (0.55) | ALDH1A1SMN1; SMN2TSHRKMT2AGSK3B | |
| SCHEMBL29429155 | 0.75 | MAPT (0.55) | ALDH1A1SMN1; SMN2TSHRKMT2AGSK3B |
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 3 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 |