Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 9/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 8/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 8/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 8/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 8/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.33 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.33 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.33 |
| ▸ | HDAC9 | Q9UKV0 | 4/20 | 0.33 |
| ▸ | HDAC5 | Q9UQL6 | 4/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | TACR3 | P29371 | 3/20 | 0.33 |
| ▸ | PDE2A | O00408 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3955607 | 0.82 | SIRT1 (0.42) | HDAC1HDAC6HDAC3HDAC2HDAC8 | |
| SCHEMBL4048868 | 0.82 | ADORA3 (0.41) | HDAC1HDAC6ADORA3ADORA2AADORA1 | |
| SCHEMBL5469798 | 0.80 | HDAC6 (0.52) | HDAC1HDAC6HDAC3HDAC2HDAC8 | |
| SCHEMBL4052446 | 0.79 | MAPT (0.47) | ALDH1A1 | |
| SCHEMBL4048617 | 0.77 | KDM4E (0.43) | ALDH1A1 | |
| SCHEMBL4048438 | 0.76 | HDAC1 (0.52) | HDAC1HDAC6HDAC3HDAC2HDAC8 | |
| SCHEMBL5461533 | 0.75 | HDAC6 (0.44) | HDAC1HDAC6HDAC3HDAC2HDAC8 | |
| SCHEMBL393077 | 0.74 | F11 (0.40) | TACR3ALDH1A1 | |
| SCHEMBL5355871 | 0.72 | HDAC1 (0.39) | HDAC1HDAC6ADORA3ADORA2APDE2A | |
| SCHEMBL5363436 | 0.72 | HDAC6 (0.55) | HDAC1HDAC6HDAC3HDAC2HDAC8 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009026701-A1 | SIRTUIN INHIBITORS | METHYLGENE INC. (CA) | 2009-03-05 | — | — | WO | disclosed |