Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 14/20 | 0.60 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.60 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.60 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.60 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.44 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.44 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.44 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.44 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.44 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.44 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.40 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7336984 | 0.92 | PDE4B (0.61) | PDE4BADORA1ADORA2AADORA2BPTGS2 | |
| SCHEMBL12027297 | 0.88 | PDE4B (0.51) | PDE4BADORA1ADORA2AADORA2B | |
| SCHEMBL4053270 | 0.80 | SMN1; SMN2 (0.49) | PDE4BADORA1ADORA2AMAPT | |
| SCHEMBL7308812 | 0.80 | PDE4B (0.60) | PDE4BADORA1ADORA2AADORA2BMAPT | |
| SCHEMBL7307639 | 0.80 | PDE4B (0.49) | PDE4BADORA1ADORA2AADORA2B | |
| SCHEMBL4061285 | 0.78 | NPC1 (0.47) | PDE4BADORA1ADORA2AADORA2BMAPT | |
| SCHEMBL2824627 | 0.77 | PDE4B (0.53) | PDE4BADORA1ADORA2AADORA2BMAPT | |
| SCHEMBL4055321 | 0.77 | HDAC1 (0.45) | PDE4BADORA1ADORA2AADORA2BPTGS2 | |
| SCHEMBL2822584 | 0.76 | PDE4B (1.00) | PDE4BADORA1ADORA2AADORA2B | |
| SCHEMBL7316189 | 0.75 | PDE4B (0.57) | PDE4BADORA1ADORA2AADORA2BMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2394998-A1 | 3-(5-Amino-6-oxo-1,6-dihydropyridazin-3-yl)-biphenyl derivatives as PDE4 inhibitors | Almirall, S.A. (ES) | 2011-12-14 | — | — | EP | disclosed |
| EP-2394998-A1 | 3-(5-Amino-6-oxo-1,6-dihydropyridazin-3-yl)-biphenyl derivatives as PDE4 inhibitors | Almirall, S.A. (ES) | 2011-12-14 | — | — | EP | disclosed |