Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 3/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.48 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | GPR68 | Q15743 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CD38 | P28907 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17220394 | 0.85 | VNN1 (0.42) | ADORA2AADORA1MAP4K4HTR2BGPR68 | |
| SCHEMBL14869738 | 0.82 | HRH4 (0.53) | HDAC3HDAC1HDAC2HDAC6HRH4 | |
| SCHEMBL17220071 | 0.74 | KCNH3 (0.44) | HRH4HRH3GPR68HTR7HTR6 | |
| SCHEMBL17220381 | 0.72 | APP (0.50) | HRH4ADORA2AADORA1GPR68HTR1A | |
| SCHEMBL796783 | 0.72 | LMNA (0.40) | HDAC3HDAC1HDAC2HDAC6NPC1 | |
| SCHEMBL796546 | 0.72 | NPC1 (0.50) | HDAC6TP53ALDH1A1NPC1RAB9A | |
| SCHEMBL14869762 | 0.72 | HRH4 (0.48) | HRH4HRH3ADORA2AMAP4K4TP53 | |
| SCHEMBL14869876 | 0.72 | HRH4 (0.48) | HRH4HRH3ADORA2AMAP4K4HTR2B | |
| SCHEMBL4377934 | 0.71 | HTR2B (0.54) | HDAC1ADORA2AHTR2BGPR68HTR1A | |
| SCHEMBL17220209 | 0.69 | HDAC3 (0.48) | HDAC3HDAC1HDAC2HDAC6HTR2B |
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 |
|---|---|---|---|---|---|---|---|
| EP-2616465-B1 | TRIAZINE-OXADIAZOLES | NOVARTIS AG (CH) | 2015-11-04 | — | — | EP | disclosed |