Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.44 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.40 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.38 |
| ▸ | PDE5A | O76074 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL5059236 | 0.91 | ADORA2A (0.42) | ADORA3ADORA2BADORA2AADORA1SMN1; SMN2 | |
| SCHEMBL5054303 | 0.82 | ADORA2B (0.42) | ADORA3ADORA2BADORA2AADORA1SMN1; SMN2 | |
| SCHEMBL5597387 | 0.80 | ADORA2A (0.39) | ADORA3ADORA2BADORA2AADORA1MAPT | |
| SCHEMBL1546006 | 0.79 | ADORA2B (0.57) | ADORA3ADORA2BADORA2AADORA1 | |
| SCHEMBL6014101 | 0.71 | ADORA2B (0.40) | ADORA3ADORA2BADORA2AADORA1SMN1; SMN2 | |
| SCHEMBL1546710 | 0.71 | ADORA2B (0.57) | ADORA3ADORA2BADORA2AADORA1CRHR1 | |
| SCHEMBL1546111 | 0.68 | ADORA2A (0.55) | ADORA3ADORA2BADORA2AADORA1 | |
| SCHEMBL1697133 | 0.68 | NR4A2 (0.48) | MAPTCYP3A4ALDH1A1MEN1KMT2A | |
| SCHEMBL5509419 | 0.68 | ADORA3 (0.44) | ADORA3ADORA2BADORA2AADORA1SMN1; SMN2 | |
| SCHEMBL1546107 | 0.67 | ADORA2B (0.54) | ADORA3ADORA2BADORA2AADORA1SMN1; SMN2 |
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-1799221-A1 | METHOD OF PREVENTING AND TREATING AIRWAY REMODELING AND PULMONARY INFLAMMATION USING A2B ADENOSINE RECEPTOR ANTAGONISTS | CV THERAPEUTICS, INC. (US) | 2007-06-27 | — | — | EP | disclosed |
| WO-2006044610-A1 | METHOD OF PREVENTING AND TREATING AIRWAY REMODELING AND PULMONARY INFLAMMATION USING A2B ADENOSINE RECEPTOR ANTAGONISTS | CV THERAPEUTICS, INC (US) | 2006-04-27 | — | — | WO | disclosed |