Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 3/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 9/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 8/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.40 |
| ▸ | HSF1 | Q00613 | 1/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 5/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | ECE1 | P42892 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | CASP1 | P29466 | 2/20 | 0.33 |
| ▸ | CASP7 | P55210 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7944114 | 0.93 | PDE4B (0.48) | PDE4BADORA1ADORA2AADORA3HSF1 | |
| SCHEMBL7947184 | 0.88 | CYP1A2 (0.45) | MEN1USP2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL3218027 | 0.87 | PDE4B (0.39) | PDE4BADORA1ADORA2AADORA3HSF1 | |
| SCHEMBL7938177 | 0.86 | PDE4B (0.41) | PDE4BADORA2AADORA2BMEN1USP2 | |
| SCHEMBL7947387 | 0.83 | ADORA1 (0.36) | PDE4BADORA1ADORA2AADORA3ADORA2B | |
| SCHEMBL7947925 | 0.82 | ADORA1 (0.36) | PDE4BADORA1ADORA2AADORA3ADORA2B | |
| SCHEMBL7944574 | 0.82 | HSF1 (0.36) | ADORA1ADORA2AADORA3HSF1ADORA2B | |
| SCHEMBL7943995 | 0.81 | HSF1 (0.36) | ADORA1ADORA2AADORA3HSF1MEN1 | |
| SCHEMBL7937747 | 0.80 | HSF1 (0.35) | ADORA1ADORA2AADORA3HSF1MEN1 | |
| SCHEMBL7937752 | 0.76 | ADORA2A (0.39) | PDE4BADORA1ADORA2AADORA3HSF1 |
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-2010008775-A1 | AMINOPYRIDOPYRAZINONE DERIVATIVES FOR TREATING NEURODEGENERATIVE DISEASES | LIGAND PHARMACEUTICALS INC. (US) | 2010-01-21 | — | — | WO | disclosed |