Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 7/20 | 0.58 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.57 |
| ▸ | PDE4A | P27815 | 2/20 | 0.55 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.55 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.55 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | RXFP1 | Q9HBX9 | 3/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL24559305 | 0.89 | ADORA2B (0.74) | ADORA2BTRPA1SMN1; SMN2RXFP1MAPK1 | |
| SCHEMBL11076150 | 0.87 | RXFP1 (0.62) | ADORA2BTRPA1PDE4APDE4BPDE4C | |
| SCHEMBL11531219 | 0.85 | ADORA2B (0.78) | ADORA2BTRPA1PDE4APDE4BPDE4C | |
| SCHEMBL24559323 | 0.85 | RXFP1 (0.70) | ADORA2BTRPA1PDE4APDE4BPDE4C | |
| SCHEMBL11145310 | 0.83 | PDE4A (0.57) | ADORA2BTRPA1PDE4APDE4BPDE4C | |
| SCHEMBL22521980 | 0.83 | ADORA2B (0.52) | ADORA2BTRPA1SMN1; SMN2RXFP1MAPK1 | |
| SCHEMBL24559396 | 0.82 | ADORA2B (0.73) | ADORA2BPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL24559298 | 0.80 | ADORA2B (0.61) | ADORA2BPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL24559134 | 0.80 | RXFP1 (0.56) | ADORA2BPDE4ASMN1; SMN2RXFP1MAPK1 | |
| SCHEMBL11074992 | 0.78 | PDE4A (0.77) | ADORA2BTRPA1PDE4APDE4BPDE4C |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4454138-A | TREATMENT OF VASCULAR DISEASES | Wuelfing, Johann A. (DE) | 1984-06-12 | — | — | US | disclosed |
| EP-0018136-B1 | XANTHINE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND THEIR USE IN PHARMACEUTICAL COMPOSITIONS | BEECHAM - WUELFING GmbH & Co. KG (DE) | 1983-11-16 | — | — | EP | disclosed |
| EP-0018136-A1 | Xanthine derivatives, a process for their preparation and their use in pharmaceutical compositions | BEECHAM - WUELFING GmbH & Co. KG (DE) | 1980-10-29 | — | — | EP | disclosed |