Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18808193 | 0.80 | CCR1 (0.36) | ADORA2AHDAC1KDM4EPDE10A | |
| SCHEMBL2733260 | 0.79 | HDAC1 (0.36) | ADORA2AHDAC1KDM4EL3MBTL1NPC1 | |
| SCHEMBL16523823 | 0.79 | HDAC1 (0.36) | ADORA2AHDAC1 | |
| SCHEMBL210170 | 0.75 | HDAC1 (0.35) | ADORA2AHDAC1CA2 | |
| SCHEMBL1755679 | 0.75 | KDM4E (0.43) | KDM4EL3MBTL1PDE10APTGS2NPC1 | |
| SCHEMBL30802846 | 0.75 | KDM4E (0.43) | KDM4EL3MBTL1PDE10APTGS2NPC1 | |
| SCHEMBL10272809 | 0.72 | PDE10A (0.46) | KDM4EL3MBTL1PDE10APTGS2NPC1 | |
| SCHEMBL15986681 | 0.72 | L3MBTL1 (0.41) | KDM4EL3MBTL1PDE10APTGS2NPC1 | |
| SCHEMBL16368521 | 0.72 | KDM4E (0.41) | KDM4EL3MBTL1PDE10APTGS2NPC1 | |
| SCHEMBL12266677 | 0.72 | KDM4E (0.41) | KDM4EL3MBTL1PDE10APTGS2NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8088805-B2 | Inhibitors of histone deacetylase | METHYLGENE INC. (CA) | 2012-01-03 | — | — | US | disclosed |