Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 8/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.42 |
| ▸ | PDE5A | O76074 | 4/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | PDE1A | P54750 | 3/20 | 0.36 |
| ▸ | PDE1B | Q01064 | 3/20 | 0.36 |
| ▸ | PDE1C | Q14123 | 3/20 | 0.36 |
| ▸ | PDE2A | O00408 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6049561 | 0.94 | ADORA2B (0.41) | ADORA2BADORA3PDE5AADORA2AADORA1 | |
| SCHEMBL6555320 | 0.89 | ADORA2B (0.44) | ADORA2BADORA3ADORA2AADORA1MEN1 | |
| SCHEMBL6049606 | 0.84 | ADORA2B (0.51) | ADORA2BADORA3ADORA2AADORA1 | |
| SCHEMBL6553631 | 0.84 | ADORA2B (0.38) | ADORA2BADORA3ADORA2AADORA1LMNA | |
| SCHEMBL6553746 | 0.84 | ADORA2B (0.53) | ADORA2BADORA3ADORA2AADORA1PDE1A | |
| SCHEMBL6553753 | 0.84 | ADORA2B (0.53) | ADORA2BADORA3ADORA2AADORA1PDE1A | |
| SCHEMBL6049598 | 0.82 | ADORA2B (0.44) | ADORA2BADORA3ADORA2AADORA1LMNA | |
| SCHEMBL17691164 | 0.82 | ADORA2B (0.44) | ADORA2BADORA3ADORA2AADORA1LMNA | |
| SCHEMBL6555742 | 0.82 | ADORA2B (0.38) | ADORA2BADORA3ADORA2AADORA1 | |
| SCHEMBL6049625 | 0.81 | ADORA2B (0.50) | ADORA2BADORA3ADORA2AADORA1 |
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-1104422-B1 | PHENYL XANTHINE DERIVATIVES | GLAXO GROUP LTD (GB) | 2004-02-18 | — | — | EP | disclosed |